4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile

C20H13N3 — CID 141122443

IUPAC4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cn4ccccc4n3)cc2)cc1
InChIInChI=1S/C20H13N3/c21-13-15-4-6-16(7-5-15)17-8-10-18(11-9-17)19-14-23-12-2-1-3-20(23)22-19/h1-12,14H
InChIKeyOQDPRPDZLZHPSI-UHFFFAOYSA-N
MW295.35 g/mol
LogP4.54
Rot. Bonds2

About 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile

4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile (PubChem CID 141122443) has the molecular formula C20H13N3 and a molecular weight of 295.35 g/mol. Its IUPAC name is 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile.

Molecular Properties

Compound Name4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
PubChem CID141122443
Molecular FormulaC20H13N3
Molecular Weight295.35 g/mol
Exact Mass295.11
IUPAC Name4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cn4ccccc4n3)cc2)cc1
InChIInChI=1S/C20H13N3/c21-13-15-4-6-16(7-5-15)17-8-10-18(11-9-17)19-14-23-12-2-1-3-20(23)22-19/h1-12,14H
InChIKeyOQDPRPDZLZHPSI-UHFFFAOYSA-N
XLogP4.54
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(E)-2-(4-imidazo[1,2-a]pyridin-2-ylphenyl)ethenyl]benzonitrile
CID 54611473
4-hydroxy-3-(4-hydroxy-3-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
CID 132991798
4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile
CID 102282894
4-[7-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]benzonitrile
CID 81463540
4-cyano-N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)benzenesulfonamide
CID 122283678
4-imidazo[1,2-a]pyridin-2-ylbenzaldehyde
CID 820963
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 852438
2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine
CID 735320
2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine;hydrobromide
CID 19234119
2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine;hydroiodide
CID 45134937
5-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-1,3-benzothiazole
CID 59282860
2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 115403226

Frequently Asked Questions

What is the IUPAC name of 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile?
The IUPAC name of 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile (CID 141122443) is 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile.
What is the SMILES notation for 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile?
The canonical SMILES for 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile is N#Cc1ccc(-c2ccc(-c3cn4ccccc4n3)cc2)cc1.
What is the InChIKey of 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile?
The InChIKey is OQDPRPDZLZHPSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N3/c21-13-15-4-6-16(7-5-15)17-8-10-18(11-9-17)19-14-23-12-2-1-3-20(23)22-19/h1-12,14H.
What are the key properties of 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile?
4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile has a molecular weight of 295.35 g/mol, XLogP of 4.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile is sourced from PubChem (CID 141122443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).