3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile

C14H11N3O — CID 28752154

IUPAC3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile
SMILESN#Cc1nc(CCc2ccco2)n2ccccc12
InChIInChI=1S/C14H11N3O/c15-10-12-13-5-1-2-8-17(13)14(16-12)7-6-11-4-3-9-18-11/h1-5,8-9H,6-7H2
InChIKeyWAGXTZJBULMZFT-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.58
Rot. Bonds3

About 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile

3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile (PubChem CID 28752154) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile.

Molecular Properties

Compound Name3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile
PubChem CID28752154
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile
SMILESN#Cc1nc(CCc2ccco2)n2ccccc12
InChIInChI=1S/C14H11N3O/c15-10-12-13-5-1-2-8-17(13)14(16-12)7-6-11-4-3-9-18-11/h1-5,8-9H,6-7H2
InChIKeyWAGXTZJBULMZFT-UHFFFAOYSA-N
XLogP2.58
TPSA54.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile?
The IUPAC name of 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile (CID 28752154) is 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile.
What is the SMILES notation for 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile?
The canonical SMILES for 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile is N#Cc1nc(CCc2ccco2)n2ccccc12.
What is the InChIKey of 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile?
The InChIKey is WAGXTZJBULMZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c15-10-12-13-5-1-2-8-17(13)14(16-12)7-6-11-4-3-9-18-11/h1-5,8-9H,6-7H2.
What are the key properties of 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile?
3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile has a molecular weight of 237.26 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile is sourced from PubChem (CID 28752154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).