1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide

C18H24N2O2 — CID 5002608

IUPAC1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCCc1ccccc1)C1CCC(=O)N1C1CCCC1
InChIInChI=1S/C18H24N2O2/c21-17-11-10-16(20(17)15-8-4-5-9-15)18(22)19-13-12-14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,19,22)
InChIKeyXVCIQWUXDUASQH-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.28
Rot. Bonds5

About 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide

1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide (PubChem CID 5002608) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide
PubChem CID5002608
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCCc1ccccc1)C1CCC(=O)N1C1CCCC1
InChIInChI=1S/C18H24N2O2/c21-17-11-10-16(20(17)15-8-4-5-9-15)18(22)19-13-12-14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,19,22)
InChIKeyXVCIQWUXDUASQH-UHFFFAOYSA-N
XLogP2.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide (CID 5002608) is 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide is O=C(NCCc1ccccc1)C1CCC(=O)N1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide?
The InChIKey is XVCIQWUXDUASQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-17-11-10-16(20(17)15-8-4-5-9-15)18(22)19-13-12-14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,19,22).
What are the key properties of 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide?
1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide has a molecular weight of 300.40 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5-oxo-N-(2-phenylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 5002608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).