1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one

C20H20N4O2 — CID 72888149

About 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one

1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one (PubChem CID 72888149) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one.

Molecular Properties

• Compound Name: 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one
• PubChem CID: 72888149
• Molecular Formula: C20H20N4O2
• Molecular Weight: 348.41 g/mol
• Exact Mass: 348.16
• IUPAC Name: 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one
• SMILES: Cc1ccc(C(=O)N2CCc3nc(-c4ccccc4)[nH]c3C2)c(=O)n1C
• InChI: InChI=1S/C20H20N4O2/c1-13-8-9-15(19(25)23(13)2)20(26)24-11-10-16-17(12-24)22-18(21-16)14-6-4-3-5-7-14/h3-9H,10-12H2,1-2H3,(H,21,22)
• InChIKey: ZUAXHZHGKFKYNX-UHFFFAOYSA-N
• XLogP: 2.28
• TPSA: 70.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 2
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	348.41
LogP ≤ 5	2.28
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one?

The IUPAC name of 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one (CID 72888149) is 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one.

What is the SMILES notation for 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one?

The canonical SMILES for 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one is Cc1ccc(C(=O)N2CCc3nc(-c4ccccc4)[nH]c3C2)c(=O)n1C.

What is the InChIKey of 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one?

The InChIKey is ZUAXHZHGKFKYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-13-8-9-15(19(25)23(13)2)20(26)24-11-10-16-17(12-24)22-18(21-16)14-6-4-3-5-7-14/h3-9H,10-12H2,1-2H3,(H,21,22).

What are the key properties of 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one?

1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one has a molecular weight of 348.41 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1,6-dimethyl-3-(2-phenyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl)pyridin-2-one is sourced from PubChem (CID 72888149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).