Products for Research Use Only
RegisterLogin

Isoquinoline-5-carboxamide

CAT: 0926-MDC88073-01Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-MDC88073-01Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1337880-73-5
MDL Number
MFCD22380136
Smiles
C1=CC2=C (C=CN=C2) C (=C1) C (=O) N
Molecular Formula
C10H8N2O
Molecular Weight
172.18 g/mol
Controlled
No

Chemical Information

Isoquinoline-5-carboxamide
CAS Number1337880-73-5
PubChem CID20493467
IUPAC Nameisoquinoline-5-carboxamide
Molecular FormulaC10H8N2O
Molecular Weight172.18
XLogP1
Topological Polar Surface Area56
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity205
SMILES
C1=CC2=C(C=CN=C2)C(=C1)C(=O)N
InChI
InChI=1S/C10H8N2O/c11-10(13)9-3-1-2-7-6-12-5-4-8(7)9/h1-6H,(H2,11,13)
InChIKey
SJFXVNZZLJUPCS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Isoquinoline-5-carboxamide
CAS: 1337880-73-5
CID: 20493467
Formula: C10H8N2O
MW: 172.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight172.18
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass172.063662883
Monoisotopic Mass172.063662883
Topological Polar Surface Area56 Ų
Heavy Atom Count13
Formal Charge0
Complexity205
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
HAA11481-01Isoquinoline-4-carboxamide
JEA54731-01Isoquinoline-5-sulfonamide
AAA39466-015-Fluoro-isoquinoline
VEA56809-015- (Trifluoromethyl) isoquinoline
RAA67559Methyl isoquinoline-5-carboxylate
FI01236-01Isoquinoline
GAC80740-015- (Piperidin-4-yl) isoquinoline
DXC60771-01Isoquinoline-5,8-diamine hydrochloride
BPA45758-014-Bromo-5-fluoro-isoquinoline
XPC90499-01Rufinamide-5-carboxamide

Alternative Products

CatalogName
OR1006317Isoquinoline-5-carboxamide
OR75919-01Isoquinoline-3-carboxamide
OR1083583Isoquinoline-1-carboxamide
OR016540-01(S) -tert-Butyl-decahydro-3-isoquinoline carboxamide
sc-252927Isoquinoline-5-carboxaldehyde
sc-506988Isoquinoline-5-carbonitrile
OR3000505- (Hydroxymethyl) isoquinoline
266080-015- (Bromomethyl) isoquinoline
OR10045915- (Methylthio) isoquinoline
OR59802Isoquinoline-5-thiocarboxamide

Popular Products