2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide

C17H24N2O2 — CID 22387114

IUPAC2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide
SMILESCCCCCC1CC(=O)N(C(C(N)=O)c2ccccc2)C1
InChIInChI=1S/C17H24N2O2/c1-2-3-5-8-13-11-15(20)19(12-13)16(17(18)21)14-9-6-4-7-10-14/h4,6-7,9-10,13,16H,2-3,5,8,11-12H2,1H3,(H2,18,21)
InChIKeyFOHQOTISNQZOSV-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.64
Rot. Bonds7

About 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide

2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide (PubChem CID 22387114) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide
PubChem CID22387114
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide
SMILESCCCCCC1CC(=O)N(C(C(N)=O)c2ccccc2)C1
InChIInChI=1S/C17H24N2O2/c1-2-3-5-8-13-11-15(20)19(12-13)16(17(18)21)14-9-6-4-7-10-14/h4,6-7,9-10,13,16H,2-3,5,8,11-12H2,1H3,(H2,18,21)
InChIKeyFOHQOTISNQZOSV-UHFFFAOYSA-N
XLogP2.64
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide?
The IUPAC name of 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide (CID 22387114) is 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide.
What is the SMILES notation for 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide?
The canonical SMILES for 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide is CCCCCC1CC(=O)N(C(C(N)=O)c2ccccc2)C1.
What is the InChIKey of 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide?
The InChIKey is FOHQOTISNQZOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-3-5-8-13-11-15(20)19(12-13)16(17(18)21)14-9-6-4-7-10-14/h4,6-7,9-10,13,16H,2-3,5,8,11-12H2,1H3,(H2,18,21).
What are the key properties of 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide?
2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide has a molecular weight of 288.39 g/mol, XLogP of 2.64, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-4-pentylpyrrolidin-1-yl)-2-phenylacetamide is sourced from PubChem (CID 22387114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).