1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide

C19H13Cl2N3OS — CID 134794164

IUPAC1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1nc(-c2ccc(Cl)cc2Cl)c2ccccn12
InChIInChI=1S/C19H13Cl2N3OS/c20-12-6-7-14(15(21)10-12)17-16-5-1-2-8-24(16)18(23-17)19(25)22-11-13-4-3-9-26-13/h1-10H,11H2,(H,22,25)
InChIKeySWXNTUVTGSXUTH-UHFFFAOYSA-N
MW402.31 g/mol
LogP5.30
Rot. Bonds4

About 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide

1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 134794164) has the molecular formula C19H13Cl2N3OS and a molecular weight of 402.31 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID134794164
Molecular FormulaC19H13Cl2N3OS
Molecular Weight402.31 g/mol
Exact Mass401.02
IUPAC Name1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1cccs1)c1nc(-c2ccc(Cl)cc2Cl)c2ccccn12
InChIInChI=1S/C19H13Cl2N3OS/c20-12-6-7-14(15(21)10-12)17-16-5-1-2-8-24(16)18(23-17)19(25)22-11-13-4-3-9-26-13/h1-10H,11H2,(H,22,25)
InChIKeySWXNTUVTGSXUTH-UHFFFAOYSA-N
XLogP5.30
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.31
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide 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 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 134794164) is 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide is O=C(NCc1cccs1)c1nc(-c2ccc(Cl)cc2Cl)c2ccccn12.
What is the InChIKey of 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is SWXNTUVTGSXUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13Cl2N3OS/c20-12-6-7-14(15(21)10-12)17-16-5-1-2-8-24(16)18(23-17)19(25)22-11-13-4-3-9-26-13/h1-10H,11H2,(H,22,25).
What are the key properties of 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide?
1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 402.31 g/mol, XLogP of 5.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-N-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 134794164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).