5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one

C22H23FN2O2 — CID 110607801

IUPAC5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one
SMILESO=C(C1CCC(=O)N1c1ccccc1)N1CCCC1Cc1ccc(F)cc1
InChIInChI=1S/C22H23FN2O2/c23-17-10-8-16(9-11-17)15-19-7-4-14-24(19)22(27)20-12-13-21(26)25(20)18-5-2-1-3-6-18/h1-3,5-6,8-11,19-20H,4,7,12-15H2
InChIKeySWOKPJIBANGYHU-UHFFFAOYSA-N
MW366.44 g/mol
LogP3.55
Rot. Bonds4

About 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one

5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one (PubChem CID 110607801) has the molecular formula C22H23FN2O2 and a molecular weight of 366.44 g/mol. Its IUPAC name is 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one.

Molecular Properties

Compound Name5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one
PubChem CID110607801
Molecular FormulaC22H23FN2O2
Molecular Weight366.44 g/mol
Exact Mass366.17
IUPAC Name5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one
SMILESO=C(C1CCC(=O)N1c1ccccc1)N1CCCC1Cc1ccc(F)cc1
InChIInChI=1S/C22H23FN2O2/c23-17-10-8-16(9-11-17)15-19-7-4-14-24(19)22(27)20-12-13-21(26)25(20)18-5-2-1-3-6-18/h1-3,5-6,8-11,19-20H,4,7,12-15H2
InChIKeySWOKPJIBANGYHU-UHFFFAOYSA-N
XLogP3.55
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-phenylmethanone
CID 110411316
2-[(4-fluorophenyl)methyl]-N-phenylpyrrolidine-1-carboxamide
CID 110601869
(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
CID 134966567
2-[2-[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-2-oxoethyl]isoindole-1,3-dione
CID 110601867
3-[2-[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-2-oxoethyl]-1-methylimidazolidine-2,4-dione
CID 56797827
(5R)-5-[(2S)-2-benzylpiperidine-1-carbonyl]pyrrolidin-2-one
CID 95351095
1-[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-2-thiophen-2-ylethanone
CID 110601864
[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-pyridin-3-ylmethanone
CID 84511159
[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]-[2-(furan-2-yl)cyclopropyl]methanone
CID 56820630
6-[(2R)-2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-2-methyl-4,5-dihydropyridazin-3-one
CID 94635684
1-phenyl-5-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 110412075
4-[(2S)-2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]benzamide
CID 94805691

Frequently Asked Questions

What is the IUPAC name of 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one?
The IUPAC name of 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one (CID 110607801) is 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one.
What is the SMILES notation for 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one?
The canonical SMILES for 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one is O=C(C1CCC(=O)N1c1ccccc1)N1CCCC1Cc1ccc(F)cc1.
What is the InChIKey of 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one?
The InChIKey is SWOKPJIBANGYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN2O2/c23-17-10-8-16(9-11-17)15-19-7-4-14-24(19)22(27)20-12-13-21(26)25(20)18-5-2-1-3-6-18/h1-3,5-6,8-11,19-20H,4,7,12-15H2.
What are the key properties of 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one?
5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one has a molecular weight of 366.44 g/mol, XLogP of 3.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[(4-fluorophenyl)methyl]pyrrolidine-1-carbonyl]-1-phenylpyrrolidin-2-one is sourced from PubChem (CID 110607801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).