N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide

C16H20N2O2 — CID 2986062

IUPACN-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C16H20N2O2/c19-15-10-12(16(20)17-13-6-4-5-7-13)11-18(15)14-8-2-1-3-9-14/h1-3,8-9,12-13H,4-7,10-11H2,(H,17,20)
InChIKeyCYVYKEJGHCCNPD-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.10
Rot. Bonds3

About N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 2986062) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID2986062
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)C1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C16H20N2O2/c19-15-10-12(16(20)17-13-6-4-5-7-13)11-18(15)14-8-2-1-3-9-14/h1-3,8-9,12-13H,4-7,10-11H2,(H,17,20)
InChIKeyCYVYKEJGHCCNPD-UHFFFAOYSA-N
XLogP2.10
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 2986062) is N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide is O=C(NC1CCCC1)C1CC(=O)N(c2ccccc2)C1.
What is the InChIKey of N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is CYVYKEJGHCCNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-15-10-12(16(20)17-13-6-4-5-7-13)11-18(15)14-8-2-1-3-9-14/h1-3,8-9,12-13H,4-7,10-11H2,(H,17,20).
What are the key properties of N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 2986062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).