N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide

C23H19FN2O3 — CID 110420365

IUPACN-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCC(=O)N1c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C23H19FN2O3/c24-16-6-8-17(9-7-16)25-23(28)21-14-15-22(27)26(21)18-10-12-20(13-11-18)29-19-4-2-1-3-5-19/h1-13,21H,14-15H2,(H,25,28)
InChIKeyIBFVRHSIQVAYMW-UHFFFAOYSA-N
MW390.41 g/mol
LogP4.75
Rot. Bonds5

About N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide

N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide (PubChem CID 110420365) has the molecular formula C23H19FN2O3 and a molecular weight of 390.41 g/mol. Its IUPAC name is N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide
PubChem CID110420365
Molecular FormulaC23H19FN2O3
Molecular Weight390.41 g/mol
Exact Mass390.14
IUPAC NameN-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCC(=O)N1c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C23H19FN2O3/c24-16-6-8-17(9-7-16)25-23(28)21-14-15-22(27)26(21)18-10-12-20(13-11-18)29-19-4-2-1-3-5-19/h1-13,21H,14-15H2,(H,25,28)
InChIKeyIBFVRHSIQVAYMW-UHFFFAOYSA-N
XLogP4.75
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.41
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373944
N-(3-methoxyphenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110421968
N-(3-acetylphenyl)-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373964
N-(4-acetylphenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110423661
5-oxo-1-phenyl-N-(4-propan-2-ylphenyl)pyrrolidine-2-carboxamide
CID 110419398
N-(2-fluorophenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110420250
N-(furan-2-ylmethyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide
CID 110408803
methyl (2S)-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxylate
CID 42261076
N-(3,5-dichlorophenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110427657
N-cyclopentyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373858
N-tert-butyl-1-(4-fluorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373922
N-(3-acetylphenyl)-1-(4-methoxyphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110374202

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide (CID 110420365) is N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide is O=C(Nc1ccc(F)cc1)C1CCC(=O)N1c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide?
The InChIKey is IBFVRHSIQVAYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN2O3/c24-16-6-8-17(9-7-16)25-23(28)21-14-15-22(27)26(21)18-10-12-20(13-11-18)29-19-4-2-1-3-5-19/h1-13,21H,14-15H2,(H,25,28).
What are the key properties of N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide?
N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide has a molecular weight of 390.41 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-5-oxo-1-(4-phenoxyphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 110420365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).