6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

C17H27N5O2 — CID 155879102

About 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (PubChem CID 155879102) has the molecular formula C17H27N5O2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

Molecular Properties

• Compound Name: 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
• PubChem CID: 155879102
• Molecular Formula: C17H27N5O2
• Molecular Weight: 333.44 g/mol
• Exact Mass: 333.22
• IUPAC Name: 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
• SMILES: CN(C)CCNC(=O)c1ncn2c1CCC(C(=O)NC1CCC1)C2
• InChI: InChI=1S/C17H27N5O2/c1-21(2)9-8-18-17(24)15-14-7-6-12(10-22(14)11-19-15)16(23)20-13-4-3-5-13/h11-13H,3-10H2,1-2H3,(H,18,24)(H,20,23)
• InChIKey: UMDXTUXKHKFAQD-UHFFFAOYSA-N
• XLogP: 0.41
• TPSA: 79.26 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	333.44
LogP ≤ 5	0.41
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?

The IUPAC name of 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (CID 155879102) is 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

What is the SMILES notation for 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?

The canonical SMILES for 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is CN(C)CCNC(=O)c1ncn2c1CCC(C(=O)NC1CCC1)C2.

What is the InChIKey of 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?

The InChIKey is UMDXTUXKHKFAQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O2/c1-21(2)9-8-18-17(24)15-14-7-6-12(10-22(14)11-19-15)16(23)20-13-4-3-5-13/h11-13H,3-10H2,1-2H3,(H,18,24)(H,20,23).

What are the key properties of 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?

6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide has a molecular weight of 333.44 g/mol, XLogP of 0.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-N-cyclobutyl-1-N-[2-(dimethylamino)ethyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is sourced from PubChem (CID 155879102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).