N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide

C16H19FN2O2 — CID 110373858

IUPACN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C(NC1CCCC1)C1CCC(=O)N1c1ccc(F)cc1
InChIInChI=1S/C16H19FN2O2/c17-11-5-7-13(8-6-11)19-14(9-10-15(19)20)16(21)18-12-3-1-2-4-12/h5-8,12,14H,1-4,9-10H2,(H,18,21)
InChIKeyPIMODLHGVQSREE-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.38
Rot. Bonds3

About N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide

N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 110373858) has the molecular formula C16H19FN2O2 and a molecular weight of 290.34 g/mol. Its IUPAC name is N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID110373858
Molecular FormulaC16H19FN2O2
Molecular Weight290.34 g/mol
Exact Mass290.14
IUPAC NameN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
SMILESO=C(NC1CCCC1)C1CCC(=O)N1c1ccc(F)cc1
InChIInChI=1S/C16H19FN2O2/c17-11-5-7-13(8-6-11)19-14(9-10-15(19)20)16(21)18-12-3-1-2-4-12/h5-8,12,14H,1-4,9-10H2,(H,18,21)
InChIKeyPIMODLHGVQSREE-UHFFFAOYSA-N
XLogP2.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide (CID 110373858) is N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide is O=C(NC1CCCC1)C1CCC(=O)N1c1ccc(F)cc1.
What is the InChIKey of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is PIMODLHGVQSREE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O2/c17-11-5-7-13(8-6-11)19-14(9-10-15(19)20)16(21)18-12-3-1-2-4-12/h5-8,12,14H,1-4,9-10H2,(H,18,21).
What are the key properties of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide?
N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 110373858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).