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

C13H9N3S — CID 116836642

IUPAC3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile
SMILESCc1ccsc1-c1nc(C#N)c2ccccn12
InChIInChI=1S/C13H9N3S/c1-9-5-7-17-12(9)13-15-10(8-14)11-4-2-3-6-16(11)13/h2-7H,1H3
InChIKeyVAWDXDBVDNYELE-UHFFFAOYSA-N
MW239.30 g/mol
LogP3.24
Rot. Bonds1

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

3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile (PubChem CID 116836642) has the molecular formula C13H9N3S and a molecular weight of 239.30 g/mol. Its IUPAC name is 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile.

Molecular Properties

Compound Name3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile
PubChem CID116836642
Molecular FormulaC13H9N3S
Molecular Weight239.30 g/mol
Exact Mass239.05
IUPAC Name3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile
SMILESCc1ccsc1-c1nc(C#N)c2ccccn12
InChIInChI=1S/C13H9N3S/c1-9-5-7-17-12(9)13-15-10(8-14)11-4-2-3-6-16(11)13/h2-7H,1H3
InChIKeyVAWDXDBVDNYELE-UHFFFAOYSA-N
XLogP3.24
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(3-methylthiophen-2-yl)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

Related Compounds

3-(4-amino-3-methoxyphenyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 84760106
3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 116836636
2-(3-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 63619127
2-(1-cyanoimidazo[1,5-a]pyridin-3-yl)-2-methylpropanoic acid
CID 116984741
3-(1-aminocyclopropyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 116984824
3-[2-(furan-2-yl)ethyl]imidazo[1,5-a]pyridine-1-carbonitrile
CID 28752154
3-piperazin-1-ylimidazo[1,5-a]pyridine-1-carbonitrile
CID 116984759
1-ethynyl-3-phenylimidazo[1,5-a]pyridine
CID 53468720
4-bromo-5-(3-methylthiophen-2-yl)-1,2-oxazole-3-carbonitrile
CID 116859130
2,5-bis(3-methylthiophen-2-yl)thiophene-3,4-dicarbonitrile
CID 146403920
N-(2,6-dimethylphenyl)-2-(3-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 809322
2,4-dimethylpyrido[2,3-b]indolizine-10-carbonitrile
CID 86288189

Frequently Asked Questions

What is the IUPAC name of 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile?
The IUPAC name of 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile (CID 116836642) is 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile.
What is the SMILES notation for 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile?
The canonical SMILES for 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile is Cc1ccsc1-c1nc(C#N)c2ccccn12.
What is the InChIKey of 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile?
The InChIKey is VAWDXDBVDNYELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3S/c1-9-5-7-17-12(9)13-15-10(8-14)11-4-2-3-6-16(11)13/h2-7H,1H3.
What are the key properties of 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile?
3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile has a molecular weight of 239.30 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylthiophen-2-yl)imidazo[1,5-a]pyridine-1-carbonitrile is sourced from PubChem (CID 116836642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).