3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide

C19H21ClN4O2 — CID 109072747

About 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109072747) has the molecular formula C19H21ClN4O2 and a molecular weight of 372.86 g/mol. Its IUPAC name is 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

• Compound Name: 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
• PubChem CID: 109072747
• Molecular Formula: C19H21ClN4O2
• Molecular Weight: 372.86 g/mol
• Exact Mass: 372.14
• IUPAC Name: 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
• SMILES: O=C(NC1CC1)c1nc(C(=O)NCc2ccc(Cl)cc2)n2c1CCCC2
• InChI: InChI=1S/C19H21ClN4O2/c20-13-6-4-12(5-7-13)11-21-19(26)17-23-16(18(25)22-14-8-9-14)15-3-1-2-10-24(15)17/h4-7,14H,1-3,8-11H2,(H,21,26)(H,22,25)
• InChIKey: GKNYZDOWQQKHLC-UHFFFAOYSA-N
• XLogP: 2.69
• TPSA: 76.02 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.86
LogP ≤ 5	2.69
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide?

The IUPAC name of 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109072747) is 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide.

What is the SMILES notation for 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide?

The canonical SMILES for 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide is O=C(NC1CC1)c1nc(C(=O)NCc2ccc(Cl)cc2)n2c1CCCC2.

What is the InChIKey of 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide?

The InChIKey is GKNYZDOWQQKHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O2/c20-13-6-4-12(5-7-13)11-21-19(26)17-23-16(18(25)22-14-8-9-14)15-3-1-2-10-24(15)17/h4-7,14H,1-3,8-11H2,(H,21,26)(H,22,25).

What are the key properties of 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide?

3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 372.86 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-N-[(4-chlorophenyl)methyl]-1-N-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109072747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).