3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine

C12H15N3S — CID 117141309

IUPAC3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(C3CCSCC3)n12
InChIInChI=1S/C12H15N3S/c13-11-3-1-2-10-8-14-12(15(10)11)9-4-6-16-7-5-9/h1-3,8-9H,4-7,13H2
InChIKeyQHYIJBJQFFRMFI-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.53
Rot. Bonds1

About 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine

3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine (PubChem CID 117141309) has the molecular formula C12H15N3S and a molecular weight of 233.34 g/mol. Its IUPAC name is 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine
PubChem CID117141309
Molecular FormulaC12H15N3S
Molecular Weight233.34 g/mol
Exact Mass233.10
IUPAC Name3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(C3CCSCC3)n12
InChIInChI=1S/C12H15N3S/c13-11-3-1-2-10-8-14-12(15(10)11)9-4-6-16-7-5-9/h1-3,8-9H,4-7,13H2
InChIKeyQHYIJBJQFFRMFI-UHFFFAOYSA-N
XLogP2.53
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine 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-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine?
The IUPAC name of 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine (CID 117141309) is 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine?
The canonical SMILES for 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine is Nc1cccc2cnc(C3CCSCC3)n12.
What is the InChIKey of 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine?
The InChIKey is QHYIJBJQFFRMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3S/c13-11-3-1-2-10-8-14-12(15(10)11)9-4-6-16-7-5-9/h1-3,8-9H,4-7,13H2.
What are the key properties of 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine?
3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine has a molecular weight of 233.34 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(thian-4-yl)imidazo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117141309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).