4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide

C22H18FN3O2 — CID 58150102

IUPAC4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(N2CC(c3ccccc3)CC2=O)ccn1)c1ccc(F)cc1
InChIInChI=1S/C22H18FN3O2/c23-18-8-6-16(7-9-18)22(28)25-20-13-19(10-11-24-20)26-14-17(12-21(26)27)15-4-2-1-3-5-15/h1-11,13,17H,12,14H2,(H,24,25,28)
InChIKeyKQTJOXKOHAPBJQ-UHFFFAOYSA-N
MW375.40 g/mol
LogP3.99
Rot. Bonds4

About 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide

4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide (PubChem CID 58150102) has the molecular formula C22H18FN3O2 and a molecular weight of 375.40 g/mol. Its IUPAC name is 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide
PubChem CID58150102
Molecular FormulaC22H18FN3O2
Molecular Weight375.40 g/mol
Exact Mass375.14
IUPAC Name4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(N2CC(c3ccccc3)CC2=O)ccn1)c1ccc(F)cc1
InChIInChI=1S/C22H18FN3O2/c23-18-8-6-16(7-9-18)22(28)25-20-13-19(10-11-24-20)26-14-17(12-21(26)27)15-4-2-1-3-5-15/h1-11,13,17H,12,14H2,(H,24,25,28)
InChIKeyKQTJOXKOHAPBJQ-UHFFFAOYSA-N
XLogP3.99
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.40
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide
CID 124636540
1-[(4-fluorophenyl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150117
N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]pyridine-2-carboxamide
CID 58150092
N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide
CID 124636526
N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]-3-phenylprop-2-enamide
CID 76687568
1-tert-butyl-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150100
1-(2-chloroethyl)-3-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]urea
CID 124636542
1-[(1-methylpiperidin-2-yl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 66971321
1-[4-[2-oxo-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea
CID 66971362
4-fluoro-N-[5-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]benzamide
CID 92884631
4-fluoro-N-[5-[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]benzamide
CID 46393282
N-(4-cyclopropyl-2-pyridinyl)benzamide
CID 140765291

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide?
The IUPAC name of 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide (CID 58150102) is 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide is O=C(Nc1cc(N2CC(c3ccccc3)CC2=O)ccn1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide?
The InChIKey is KQTJOXKOHAPBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O2/c23-18-8-6-16(7-9-18)22(28)25-20-13-19(10-11-24-20)26-14-17(12-21(26)27)15-4-2-1-3-5-15/h1-11,13,17H,12,14H2,(H,24,25,28).
What are the key properties of 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide?
4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide has a molecular weight of 375.40 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 58150102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).