2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile

C15H11ClN4 — CID 13259041

IUPAC2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESCc1ccc2nc(-c3ccc(Cl)cn3)c(CC#N)n2c1
InChIInChI=1S/C15H11ClN4/c1-10-2-5-14-19-15(12-4-3-11(16)8-18-12)13(6-7-17)20(14)9-10/h2-5,8-9H,6H2,1H3
InChIKeyVAYJWPDGOYWYEN-UHFFFAOYSA-N
MW282.73 g/mol
LogP3.42
Rot. Bonds2

About 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile

2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile (PubChem CID 13259041) has the molecular formula C15H11ClN4 and a molecular weight of 282.73 g/mol. Its IUPAC name is 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile.

Molecular Properties

Compound Name2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
PubChem CID13259041
Molecular FormulaC15H11ClN4
Molecular Weight282.73 g/mol
Exact Mass282.07
IUPAC Name2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESCc1ccc2nc(-c3ccc(Cl)cn3)c(CC#N)n2c1
InChIInChI=1S/C15H11ClN4/c1-10-2-5-14-19-15(12-4-3-11(16)8-18-12)13(6-7-17)20(14)9-10/h2-5,8-9H,6H2,1H3
InChIKeyVAYJWPDGOYWYEN-UHFFFAOYSA-N
XLogP3.42
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.73
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(5-bromofuran-2-yl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 13259035
2-[6-bromo-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82030121
2-[2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39127619
2-[2-(2,5-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39133975
2-(7-chloro-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 82529975
2-[2-(2,4-dimethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060558
3-(chloromethyl)-6-methyl-2-pyridin-4-ylimidazo[1,2-a]pyridine
CID 39133014
4-[6-chloro-3-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-2-yl]benzonitrile
CID 51360052
2-(3-chlorophenyl)-3-[(3-chlorophenyl)methyl]-6-methylimidazo[1,2-a]pyridine
CID 51359989
2-[7-chloro-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82343208
N-methyl-1-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 70326815
2-(6-chloro-8-methyl-2-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 82531110

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The IUPAC name of 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile (CID 13259041) is 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile.
What is the SMILES notation for 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The canonical SMILES for 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile is Cc1ccc2nc(-c3ccc(Cl)cn3)c(CC#N)n2c1.
What is the InChIKey of 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The InChIKey is VAYJWPDGOYWYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4/c1-10-2-5-14-19-15(12-4-3-11(16)8-18-12)13(6-7-17)20(14)9-10/h2-5,8-9H,6H2,1H3.
What are the key properties of 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile?
2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile has a molecular weight of 282.73 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-chloro-2-pyridinyl)-6-methylimidazo[1,2-a]pyridin-3-yl]acetonitrile is sourced from PubChem (CID 13259041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).