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

C15H11N3 — CID 102282894

IUPAC4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile
SMILESN#Cc1ccc(Cc2cn3ccccc3n2)cc1
InChIInChI=1S/C15H11N3/c16-10-13-6-4-12(5-7-13)9-14-11-18-8-2-1-3-15(18)17-14/h1-8,11H,9H2
InChIKeySALYFZIFYXZBNB-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.80
Rot. Bonds2

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

4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile (PubChem CID 102282894) has the molecular formula C15H11N3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile.

Molecular Properties

Compound Name4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile
PubChem CID102282894
Molecular FormulaC15H11N3
Molecular Weight233.27 g/mol
Exact Mass233.10
IUPAC Name4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile
SMILESN#Cc1ccc(Cc2cn3ccccc3n2)cc1
InChIInChI=1S/C15H11N3/c16-10-13-6-4-12(5-7-13)9-14-11-18-8-2-1-3-15(18)17-14/h1-8,11H,9H2
InChIKeySALYFZIFYXZBNB-UHFFFAOYSA-N
XLogP2.80
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 852438
4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
CID 141122443
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methylbenzonitrile
CID 103760082
N-[(4-cyanophenyl)methyl]-4-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzamide
CID 134035536
4-[(E)-2-(4-imidazo[1,2-a]pyridin-2-ylphenyl)ethenyl]benzonitrile
CID 54611473
imidazo[1,2-a]pyridin-2-ylmethylazanium
CID 7012186
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-5-methoxybenzonitrile
CID 103567182
4-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]benzonitrile;hydrochloride
CID 19032464
2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzonitrile
CID 7433386
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
4-[(imidazo[1,2-a]pyridin-2-ylmethylamino)methyl]phenol
CID 115572847
2-imidazo[1,2-a]pyridin-2-ylethanamine
CID 7536516

Frequently Asked Questions

What is the IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile?
The IUPAC name of 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile (CID 102282894) is 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile.
What is the SMILES notation for 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile?
The canonical SMILES for 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile is N#Cc1ccc(Cc2cn3ccccc3n2)cc1.
What is the InChIKey of 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile?
The InChIKey is SALYFZIFYXZBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3/c16-10-13-6-4-12(5-7-13)9-14-11-18-8-2-1-3-15(18)17-14/h1-8,11H,9H2.
What are the key properties of 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile?
4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile has a molecular weight of 233.27 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile is sourced from PubChem (CID 102282894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).