(2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide

C₂₁H₂₆N₂O₃ — CID 163211996

About (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide

(2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide (PubChem CID 163211996) has the molecular formula C₂₁H₂₆N₂O₃ and a molecular weight of 354.45 g/mol. Its IUPAC name is (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide.

Molecular Properties

• Compound Name: (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide
• PubChem CID: 163211996
• Molecular Formula: C₂₁H₂₆N₂O₃
• Molecular Weight: 354.45 g/mol
• Exact Mass: 354.19
• IUPAC Name: (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide
• SMILES: CC(C)C[C@@H](NC(=O)C(C)(c1ccccc1)c1ccccc1)C(=O)NO
• InChI: InChI=1S/C21H26N2O3/c1-15(2)14-18(19(24)23-26)22-20(25)21(3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,18,26H,14H2,1-3H3,(H,22,25)(H,23,24)/t18-/m1/s1
• InChIKey: KJASJBJHZIJJMK-GOSISDBHSA-N
• XLogP: 3.03
• TPSA: 78.43 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	354.45
LogP ≤ 5	3.03
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide?

The IUPAC name of (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide (CID 163211996) is (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide.

What is the SMILES notation for (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide?

The canonical SMILES for (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide is CC(C)C[C@@H](NC(=O)C(C)(c1ccccc1)c1ccccc1)C(=O)NO.

What is the InChIKey of (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide?

The InChIKey is KJASJBJHZIJJMK-GOSISDBHSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-15(2)14-18(19(24)23-26)22-20(25)21(3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,18,26H,14H2,1-3H3,(H,22,25)(H,23,24)/t18-/m1/s1.

What are the key properties of (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide?

(2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide has a molecular weight of 354.45 g/mol, XLogP of 3.03, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-(2,2-diphenylpropanoylamino)-N-hydroxy-4-methylpentanamide is sourced from PubChem (CID 163211996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 163211996 — identifiers, structure, computed properties (public domain)

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