5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide

C20H24N4O2 — CID 131935989

About 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide

5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 131935989) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide
• PubChem CID: 131935989
• Molecular Formula: C20H24N4O2
• Molecular Weight: 352.44 g/mol
• Exact Mass: 352.19
• IUPAC Name: 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide
• SMILES: Cc1ccc2nc(C(NC(=O)c3cc(C)c(C)[nH]c3=O)C(C)C)[nH]c2c1
• InChI: InChI=1S/C20H24N4O2/c1-10(2)17(18-22-15-7-6-11(3)8-16(15)23-18)24-20(26)14-9-12(4)13(5)21-19(14)25/h6-10,17H,1-5H3,(H,21,25)(H,22,23)(H,24,26)
• InChIKey: DQXTWUPMQHCCQZ-UHFFFAOYSA-N
• XLogP: 3.30
• TPSA: 90.64 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.44
LogP ≤ 5	3.30
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide?

The IUPAC name of 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide (CID 131935989) is 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide.

What is the SMILES notation for 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide?

The canonical SMILES for 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc2nc(C(NC(=O)c3cc(C)c(C)[nH]c3=O)C(C)C)[nH]c2c1.

What is the InChIKey of 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide?

The InChIKey is DQXTWUPMQHCCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-10(2)17(18-22-15-7-6-11(3)8-16(15)23-18)24-20(26)14-9-12(4)13(5)21-19(14)25/h6-10,17H,1-5H3,(H,21,25)(H,22,23)(H,24,26).

What are the key properties of 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide?

5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 3.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 5,6-dimethyl-N-[2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)propyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 131935989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).