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Meprocin

CAT: 0926-NFB03503-02Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0926-NFB03503-02Size:1 mg
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CAS Number
763035-03-6
Smiles
OC1=CC=CC=2NC=C (C12) CCN (C) CCC
Molecular Formula
C14H20N2O
Molecular Weight
232.32 g/mol
Controlled
Yes

Chemical Information

3-(2-(Methylpropylamino)ethyl)-1H-indol-4-ol
CAS Number763035-03-6
PubChem CID21786584
IUPAC Name3-[2-[methyl(propyl)amino]ethyl]-1H-indol-4-ol
Molecular FormulaC14H20N2O
Molecular Weight232.32
XLogP2.9
Topological Polar Surface Area39.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity234
SMILES
CCCN(C)CCC1=CNC2=C1C(=CC=C2)O
InChI
InChI=1S/C14H20N2O/c1-3-8-16(2)9-7-11-10-15-12-5-4-6-13(17)14(11)12/h4-6,10,15,17H,3,7-9H2,1-2H3
InChIKey
XFQDDPQGBLSNCN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(2-(Methylpropylamino)ethyl)-1H-indol-4-ol
CAS: 763035-03-6
CID: 21786584
Formula: C14H20N2O
MW: 232.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight232.32
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass232.157563266
Monoisotopic Mass232.157563266
Topological Polar Surface Area39.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity234
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