2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile

C14H11N5 — CID 82143696

IUPAC2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile
SMILESCc1cnc2c(c1)nc(-c1ccncc1)n2CC#N
InChIInChI=1S/C14H11N5/c1-10-8-12-14(17-9-10)19(7-4-15)13(18-12)11-2-5-16-6-3-11/h2-3,5-6,8-9H,7H2,1H3
InChIKeyPKXRUAVHHJQDSQ-UHFFFAOYSA-N
MW249.28 g/mol
LogP2.33
Rot. Bonds2

About 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile

2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile (PubChem CID 82143696) has the molecular formula C14H11N5 and a molecular weight of 249.28 g/mol. Its IUPAC name is 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile.

Molecular Properties

Compound Name2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile
PubChem CID82143696
Molecular FormulaC14H11N5
Molecular Weight249.28 g/mol
Exact Mass249.10
IUPAC Name2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile
SMILESCc1cnc2c(c1)nc(-c1ccncc1)n2CC#N
InChIInChI=1S/C14H11N5/c1-10-8-12-14(17-9-10)19(7-4-15)13(18-12)11-2-5-16-6-3-11/h2-3,5-6,8-9H,7H2,1H3
InChIKeyPKXRUAVHHJQDSQ-UHFFFAOYSA-N
XLogP2.33
TPSA67.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.28
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3,4-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]acetonitrile
CID 82143683
2-methyl-3-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)propanenitrile
CID 82146414
3-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
CID 82061571
2-[6-chloro-2-(4-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]acetonitrile
CID 82143724
3-(6-chloro-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)propanethioamide
CID 94757877
2-(6-ethyl-4-oxo-2-pyridin-4-ylthieno[2,3-d]pyrimidin-3-yl)acetonitrile
CID 39158870
3-(6-methyl-2-phenylimidazo[4,5-b]pyridin-3-yl)propanoic acid
CID 82061511
3-[6-chloro-2-(4-methylphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 82150963
4-[(2,6-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]benzonitrile
CID 82150674
1-ethyl-2-pyridin-4-ylbenzimidazole-5-carbonitrile
CID 65034992
2-[2-(3,4-dimethylphenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150776
3-ethyl-2,6-dimethylimidazo[4,5-b]pyridine
CID 162381340

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile?
The IUPAC name of 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile (CID 82143696) is 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile.
What is the SMILES notation for 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile?
The canonical SMILES for 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile is Cc1cnc2c(c1)nc(-c1ccncc1)n2CC#N.
What is the InChIKey of 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile?
The InChIKey is PKXRUAVHHJQDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5/c1-10-8-12-14(17-9-10)19(7-4-15)13(18-12)11-2-5-16-6-3-11/h2-3,5-6,8-9H,7H2,1H3.
What are the key properties of 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile?
2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile has a molecular weight of 249.28 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)acetonitrile is sourced from PubChem (CID 82143696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).