6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

C18H28N4O2 — CID 155872322

About 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (PubChem CID 155872322) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

Molecular Properties

• Compound Name: 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
• PubChem CID: 155872322
• Molecular Formula: C18H28N4O2
• Molecular Weight: 332.45 g/mol
• Exact Mass: 332.22
• IUPAC Name: 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
• SMILES: CC(C)CCNC(=O)c1ncn2c1CCC(C(=O)NC1CCC1)C2
• InChI: InChI=1S/C18H28N4O2/c1-12(2)8-9-19-18(24)16-15-7-6-13(10-22(15)11-20-16)17(23)21-14-4-3-5-14/h11-14H,3-10H2,1-2H3,(H,19,24)(H,21,23)
• InChIKey: YULPYPJLCCWYCP-UHFFFAOYSA-N
• XLogP: 1.89
• TPSA: 76.02 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	332.45
LogP ≤ 5	1.89
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (CID 155872322) is 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

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

The canonical SMILES for 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is CC(C)CCNC(=O)c1ncn2c1CCC(C(=O)NC1CCC1)C2.

What is the InChIKey of 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?

The InChIKey is YULPYPJLCCWYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-12(2)8-9-19-18(24)16-15-7-6-13(10-22(15)11-20-16)17(23)21-14-4-3-5-14/h11-14H,3-10H2,1-2H3,(H,19,24)(H,21,23).

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

6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide has a molecular weight of 332.45 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6-N-cyclobutyl-1-N-(3-methylbutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is sourced from PubChem (CID 155872322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).