7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine

C15H14N2S — CID 918875

IUPAC7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine
SMILESCc1ccn2cc(CSc3ccccc3)nc2c1
InChIInChI=1S/C15H14N2S/c1-12-7-8-17-10-13(16-15(17)9-12)11-18-14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKeyNYQUAHXFIISQCN-UHFFFAOYSA-N
MW254.36 g/mol
LogP3.94
Rot. Bonds3

About 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine

7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine (PubChem CID 918875) has the molecular formula C15H14N2S and a molecular weight of 254.36 g/mol. Its IUPAC name is 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine
PubChem CID918875
Molecular FormulaC15H14N2S
Molecular Weight254.36 g/mol
Exact Mass254.09
IUPAC Name7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine
SMILESCc1ccn2cc(CSc3ccccc3)nc2c1
InChIInChI=1S/C15H14N2S/c1-12-7-8-17-10-13(16-15(17)9-12)11-18-14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKeyNYQUAHXFIISQCN-UHFFFAOYSA-N
XLogP3.94
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine 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 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine (CID 918875) is 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine is Cc1ccn2cc(CSc3ccccc3)nc2c1.
What is the InChIKey of 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is NYQUAHXFIISQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S/c1-12-7-8-17-10-13(16-15(17)9-12)11-18-14-5-3-2-4-6-14/h2-10H,11H2,1H3.
What are the key properties of 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine?
7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 254.36 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(phenylsulfanylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 918875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).