1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine

C12H13ClN2S — CID 117250336

IUPAC1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine
SMILESCc1cccc2c(Cl)nc(C3CCSC3)n12
InChIInChI=1S/C12H13ClN2S/c1-8-3-2-4-10-11(13)14-12(15(8)10)9-5-6-16-7-9/h2-4,9H,5-7H2,1H3
InChIKeyHUFJOXRASJKEBT-UHFFFAOYSA-N
MW252.77 g/mol
LogP3.52
Rot. Bonds1

About 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine

1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine (PubChem CID 117250336) has the molecular formula C12H13ClN2S and a molecular weight of 252.77 g/mol. Its IUPAC name is 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine
PubChem CID117250336
Molecular FormulaC12H13ClN2S
Molecular Weight252.77 g/mol
Exact Mass252.05
IUPAC Name1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine
SMILESCc1cccc2c(Cl)nc(C3CCSC3)n12
InChIInChI=1S/C12H13ClN2S/c1-8-3-2-4-10-11(13)14-12(15(8)10)9-5-6-16-7-9/h2-4,9H,5-7H2,1H3
InChIKeyHUFJOXRASJKEBT-UHFFFAOYSA-N
XLogP3.52
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.77
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-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

Related Compounds

1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridin-5-ol
CID 117250297
1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-5-amine
CID 83869325
1-chloro-3-(thiolan-3-yl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251569
[1-methyl-2-(thiolan-3-yl)benzimidazol-4-yl]methanamine
CID 104721367
1-chloro-5-methyl-3-(2-methylphenyl)imidazo[1,5-a]pyridine
CID 117250780
1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one
CID 83840054
1-bromo-5-methyl-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine
CID 84744309
1-chloro-3-(furan-2-yl)-5-methylimidazo[1,5-a]pyridine
CID 117250495
1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-5-ol
CID 117250398
1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 117250887
5-chloro-2-(thiolan-3-yl)imidazo[1,2-a]pyridine
CID 117131140
1-bromo-7-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine
CID 117251630

Frequently Asked Questions

What is the IUPAC name of 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine?
The IUPAC name of 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine (CID 117250336) is 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine?
The canonical SMILES for 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine is Cc1cccc2c(Cl)nc(C3CCSC3)n12.
What is the InChIKey of 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine?
The InChIKey is HUFJOXRASJKEBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2S/c1-8-3-2-4-10-11(13)14-12(15(8)10)9-5-6-16-7-9/h2-4,9H,5-7H2,1H3.
What are the key properties of 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine?
1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine has a molecular weight of 252.77 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-5-methyl-3-(thiolan-3-yl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 117250336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).