Products for Research Use Only
RegisterLogin

Compound Fr13837

CAT: 0013-GTR19269986-01Size: 2 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19269986-01Size:2 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Compound Fr13837, with CAS No. 486414-86-2, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr13837 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
486414-86-2
Smiles
CN1C=NC=C1CN
Molecular Formula
C5H9N3
Molecular Weight
111.15
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-Methyl-5-aminomethylimidazole
CAS Number486414-86-2
PubChem CID2795424
IUPAC Name(3-methylimidazol-4-yl)methanamine
Molecular FormulaC5H9N3
Molecular Weight111.15
XLogP-1.1
Topological Polar Surface Area43.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count8
Formal Charge0
Complexity74
SMILES
CN1C=NC=C1CN
InChI
InChI=1S/C5H9N3/c1-8-4-7-3-5(8)2-6/h3-4H,2,6H2,1H3
InChIKey
PYAQTQXFMQWCHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Methyl-5-aminomethylimidazole
CAS: 486414-86-2
CID: 2795424
Formula: C5H9N3
MW: 111.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight111.15
XLogP3-1.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass111.079647300
Monoisotopic Mass111.079647300
Topological Polar Surface Area43.8 Ų
Heavy Atom Count8
Formal Charge0
Complexity74.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19269870-01Compound Fr13037
GTR19269987-01Compound Fr13839
GTR19269966-01Compound Fr13737
GTR19269985-01Compound Fr13836
GTR19269983-01Compound Fr13817
GTR19269976-01Compound Fr13783
GTR19269932-01Compound Fr13547
GTR19269897-01Compound Fr13232
GTR19269893-01Compound Fr13217
GTR19269872-01Compound Fr13057

Alternative Products

CatalogName
ALX-550-516-M025Compound A
XXC35825-01Compound 3a
Fr16729-01Compound Fr16729
PDK0296-01Compound PDK0296
PDK0264-01Compound PDK0264
Fr14090-01Compound Fr14090
Fr14018-01Compound Fr14018
Fr13991-01Compound Fr13991
Fr13830-01Compound Fr13830
Fr13814-01Compound Fr13814

Popular Products