4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine

C30H32N6O — CID 144996910

IUPAC4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
SMILESCN1CCCCC1.COc1cc(-c2ccc(C#N)cc2)c(-c2ccc3c(c2)nc(C)n3C)n2cncc12
InChIInChI=1S/C24H19N5O.C6H13N/c1-15-27-20-10-18(8-9-21(20)28(15)2)24-19(17-6-4-16(12-25)5-7-17)11-23(30-3)22-13-26-14-29(22)24;1-7-5-3-2-4-6-7/h4-11,13-14H,1-3H3;2-6H2,1H3
InChIKeyBIDCWQIPNZDYPB-UHFFFAOYSA-N
MW492.63 g/mol
LogP5.85
Rot. Bonds3

About 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine

4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine (PubChem CID 144996910) has the molecular formula C30H32N6O and a molecular weight of 492.63 g/mol. Its IUPAC name is 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine.

Molecular Properties

Compound Name4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
PubChem CID144996910
Molecular FormulaC30H32N6O
Molecular Weight492.63 g/mol
Exact Mass492.26
IUPAC Name4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
SMILESCN1CCCCC1.COc1cc(-c2ccc(C#N)cc2)c(-c2ccc3c(c2)nc(C)n3C)n2cncc12
InChIInChI=1S/C24H19N5O.C6H13N/c1-15-27-20-10-18(8-9-21(20)28(15)2)24-19(17-6-4-16(12-25)5-7-17)11-23(30-3)22-13-26-14-29(22)24;1-7-5-3-2-4-6-7/h4-11,13-14H,1-3H3;2-6H2,1H3
InChIKeyBIDCWQIPNZDYPB-UHFFFAOYSA-N
XLogP5.85
TPSA71.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.63
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[5-[6-(dimethylamino)-3-pyridinyl]-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
CID 144996966
4-[5-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-6-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
CID 144996948
4-[5-(5-fluoro-6-morpholin-4-yl-3-pyridinyl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine
CID 144996951
4-[5-[4-(1-hydroxyethyl)phenyl]-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 144996974
4-(5-chloro-8-methoxyimidazo[1,5-a]pyridin-6-yl)benzonitrile;1-ethylpiperidine
CID 144996855
4-[8-methoxy-5-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 144996879
4-[5-(5,6-dimethyl-3-pyridinyl)-8-[[(3R)-1-methylpiperidin-3-yl]methoxy]imidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 118647481
4-[5-(5-amino-6-methoxy-3-pyridinyl)-8-[[(3R)-1-methylpiperidin-3-yl]methoxy]imidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 118647425
4-[5-[3-fluoro-4-(hydroxymethyl)-5-methylphenyl]-8-[[(3R)-1-methylpiperidin-3-yl]methoxy]imidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 118647536
4-[5-[5-amino-6-[amino(cyclopropyl)amino]-3-pyridinyl]-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 144996918
6-(4-fluorophenyl)-8-methoxy-5-(4-methylphenyl)imidazo[1,5-a]pyridine;pyrrolidine
CID 144996955
4-[5-(5-fluoro-6-morpholin-4-yl-3-pyridinyl)-8-[[(3R)-1-methylpiperidin-3-yl]methoxy]imidazo[1,5-a]pyridin-6-yl]benzonitrile
CID 118647497

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine?
The IUPAC name of 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine (CID 144996910) is 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine.
What is the SMILES notation for 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine?
The canonical SMILES for 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine is CN1CCCCC1.COc1cc(-c2ccc(C#N)cc2)c(-c2ccc3c(c2)nc(C)n3C)n2cncc12.
What is the InChIKey of 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine?
The InChIKey is BIDCWQIPNZDYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O.C6H13N/c1-15-27-20-10-18(8-9-21(20)28(15)2)24-19(17-6-4-16(12-25)5-7-17)11-23(30-3)22-13-26-14-29(22)24;1-7-5-3-2-4-6-7/h4-11,13-14H,1-3H3;2-6H2,1H3.
What are the key properties of 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine?
4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine has a molecular weight of 492.63 g/mol, XLogP of 5.85, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1,2-dimethylbenzimidazol-5-yl)-8-methoxyimidazo[1,5-a]pyridin-6-yl]benzonitrile;1-methylpiperidine is sourced from PubChem (CID 144996910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).