N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide

C24H30N4O4 — CID 10274851

About N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide

N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide (PubChem CID 10274851) has the molecular formula C24H30N4O4 and a molecular weight of 438.53 g/mol. Its IUPAC name is N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide.

Molecular Properties

• Compound Name: N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide
• PubChem CID: 10274851
• Molecular Formula: C24H30N4O4
• Molecular Weight: 438.53 g/mol
• Exact Mass: 438.23
• IUPAC Name: N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide
• SMILES: CC(=O)Nc1ccccc1OCC(C)(O)CN1CCC(n2c(=O)[nH]c3ccccc32)CC1
• InChI: InChI=1S/C24H30N4O4/c1-17(29)25-20-8-4-6-10-22(20)32-16-24(2,31)15-27-13-11-18(12-14-27)28-21-9-5-3-7-19(21)26-23(28)30/h3-10,18,31H,11-16H2,1-2H3,(H,25,29)(H,26,30)
• InChIKey: LGGKWFFPRSCRAI-UHFFFAOYSA-N
• XLogP: 2.75
• TPSA: 99.59 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	438.53
LogP ≤ 5	2.75
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide?

The IUPAC name of N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide (CID 10274851) is N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide.

What is the SMILES notation for N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide?

The canonical SMILES for N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide is CC(=O)Nc1ccccc1OCC(C)(O)CN1CCC(n2c(=O)[nH]c3ccccc32)CC1.

What is the InChIKey of N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide?

The InChIKey is LGGKWFFPRSCRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O4/c1-17(29)25-20-8-4-6-10-22(20)32-16-24(2,31)15-27-13-11-18(12-14-27)28-21-9-5-3-7-19(21)26-23(28)30/h3-10,18,31H,11-16H2,1-2H3,(H,25,29)(H,26,30).

What are the key properties of N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide?

N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide has a molecular weight of 438.53 g/mol, XLogP of 2.75, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[2-hydroxy-2-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propoxy]phenyl]acetamide is sourced from PubChem (CID 10274851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).