2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile

C16H13N3O2 — CID 82060349

IUPAC2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
SMILESCOc1ccc(OC)c(-c2cn3cc(C#N)ccc3n2)c1
InChIInChI=1S/C16H13N3O2/c1-20-12-4-5-15(21-2)13(7-12)14-10-19-9-11(8-17)3-6-16(19)18-14/h3-7,9-10H,1-2H3
InChIKeyUFKQFWKPTKHWFK-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.89
Rot. Bonds3

About 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile

2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile (PubChem CID 82060349) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
PubChem CID82060349
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
SMILESCOc1ccc(OC)c(-c2cn3cc(C#N)ccc3n2)c1
InChIInChI=1S/C16H13N3O2/c1-20-12-4-5-15(21-2)13(7-12)14-10-19-9-11(8-17)3-6-16(19)18-14/h3-7,9-10H,1-2H3
InChIKeyUFKQFWKPTKHWFK-UHFFFAOYSA-N
XLogP2.89
TPSA59.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060343
2-(2,5-dimethoxyphenyl)-N-ethylimidazo[1,2-a]pyridin-6-amine
CID 82059748
3-(2,5-dimethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile
CID 105392647
2-(2,5-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-8-amine
CID 82059402
2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060342
2-(2,5-dimethoxyphenyl)-5-methylimidazo[1,2-a]pyridin-6-amine
CID 82060125
2-amino-4-(4-cyanophenyl)-6-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile
CID 3554219
2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 82357020
4,6-bis(2,5-dimethoxyphenyl)pyrimidin-2-amine
CID 75359779
[2-(2-methoxy-5-methylphenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 81462901
5-(2,5-dimethoxyphenyl)pyridine-3-carbonitrile
CID 82117371
2-(3-methyl-4-phenylmethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 58191859

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The IUPAC name of 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile (CID 82060349) is 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile is COc1ccc(OC)c(-c2cn3cc(C#N)ccc3n2)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The InChIKey is UFKQFWKPTKHWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-20-12-4-5-15(21-2)13(7-12)14-10-19-9-11(8-17)3-6-16(19)18-14/h3-7,9-10H,1-2H3.
What are the key properties of 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile has a molecular weight of 279.30 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile is sourced from PubChem (CID 82060349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).