2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide

C17H15FN2O2 — CID 7546766

IUPAC2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1F
InChIInChI=1S/C17H15FN2O2/c18-15-9-5-4-8-14(15)17(22)19-12-10-16(21)20(11-12)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,19,22)/t12-/m0/s1
InChIKeyFTVKGZKWTANDBR-LBPRGKRZSA-N
MW298.32 g/mol
LogP2.36
Rot. Bonds3

About 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide

2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide (PubChem CID 7546766) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
PubChem CID7546766
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
SMILESO=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1F
InChIInChI=1S/C17H15FN2O2/c18-15-9-5-4-8-14(15)17(22)19-12-10-16(21)20(11-12)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,19,22)/t12-/m0/s1
InChIKeyFTVKGZKWTANDBR-LBPRGKRZSA-N
XLogP2.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7546765
2,3,4-trifluoro-N-(5-oxo-1-phenylpyrrolidin-3-yl)benzamide
CID 110736815
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-2-(trifluoromethyl)benzamide
CID 7546827
2-chloro-N-[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 7563633
2-nitro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 7254959
2,6-difluoro-N-[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 43971184
2,6-difluoro-N-[(3R)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 7547250
2-(4-fluorophenyl)-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7254979
N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]thiophene-2-carboxamide
CID 7255002
2-fluoro-N-(1-phenylpiperidin-3-yl)benzamide
CID 136525999
1,1-dimethyl-3-(5-oxo-1-phenylpyrrolidin-3-yl)urea
CID 18564044
N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-4-phenylbenzamide
CID 7563663

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide?
The IUPAC name of 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide (CID 7546766) is 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide?
The canonical SMILES for 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide is O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide?
The InChIKey is FTVKGZKWTANDBR-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H15FN2O2/c18-15-9-5-4-8-14(15)17(22)19-12-10-16(21)20(11-12)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,19,22)/t12-/m0/s1.
What are the key properties of 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide?
2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide has a molecular weight of 298.32 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]benzamide is sourced from PubChem (CID 7546766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).