N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide

C16H19FN2O2 — CID 6493306

IUPACN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)C1CC(=O)N(c2ccc(F)cc2)C1
InChIInChI=1S/C16H19FN2O2/c17-12-5-7-14(8-6-12)19-10-11(9-15(19)20)16(21)18-13-3-1-2-4-13/h5-8,11,13H,1-4,9-10H2,(H,18,21)
InChIKeyXVIGTUOAAJFITI-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.24
Rot. Bonds3

About N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide

N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 6493306) 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-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID6493306
Molecular FormulaC16H19FN2O2
Molecular Weight290.34 g/mol
Exact Mass290.14
IUPAC NameN-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)C1CC(=O)N(c2ccc(F)cc2)C1
InChIInChI=1S/C16H19FN2O2/c17-12-5-7-14(8-6-12)19-10-11(9-15(19)20)16(21)18-13-3-1-2-4-13/h5-8,11,13H,1-4,9-10H2,(H,18,21)
InChIKeyXVIGTUOAAJFITI-UHFFFAOYSA-N
XLogP2.24
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 ≤ 52.24
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-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide (CID 6493306) is N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide is O=C(NC1CCCC1)C1CC(=O)N(c2ccc(F)cc2)C1.
What is the InChIKey of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is XVIGTUOAAJFITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O2/c17-12-5-7-14(8-6-12)19-10-11(9-15(19)20)16(21)18-13-3-1-2-4-13/h5-8,11,13H,1-4,9-10H2,(H,18,21).
What are the key properties of N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide?
N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 2.24, 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-3-carboxamide is sourced from PubChem (CID 6493306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).