3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide

C22H25FN2O2 — CID 110633755

IUPAC3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccc(CCC(=O)N2CCCC2)cc1
InChIInChI=1S/C22H25FN2O2/c23-19-9-3-17(4-10-19)7-13-21(26)24-20-11-5-18(6-12-20)8-14-22(27)25-15-1-2-16-25/h3-6,9-12H,1-2,7-8,13-16H2,(H,24,26)
InChIKeyQWYHLPGNAXQYSJ-UHFFFAOYSA-N
MW368.45 g/mol
LogP3.95
Rot. Bonds7

About 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide

3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide (PubChem CID 110633755) has the molecular formula C22H25FN2O2 and a molecular weight of 368.45 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide
PubChem CID110633755
Molecular FormulaC22H25FN2O2
Molecular Weight368.45 g/mol
Exact Mass368.19
IUPAC Name3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide
SMILESO=C(CCc1ccc(F)cc1)Nc1ccc(CCC(=O)N2CCCC2)cc1
InChIInChI=1S/C22H25FN2O2/c23-19-9-3-17(4-10-19)7-13-21(26)24-20-11-5-18(6-12-20)8-14-22(27)25-15-1-2-16-25/h3-6,9-12H,1-2,7-8,13-16H2,(H,24,26)
InChIKeyQWYHLPGNAXQYSJ-UHFFFAOYSA-N
XLogP3.95
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]pentanamide
CID 110314338
4-[3-(4-fluorophenyl)propanoyl]-N-phenyl-1,4-diazepane-1-carboxamide
CID 110811792
4-[3-oxo-3-[4-(pyrrolidine-1-carbonyl)anilino]propyl]benzoic acid
CID 119180120
3-(4-fluorophenyl)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 27844351
3-(4-fluorophenyl)-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]propanamide
CID 110622806
3-(4-fluorophenyl)-1-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]propan-1-one
CID 134046846
3-(4-fluorophenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 38167098
3-(4-fluorophenyl)-N-pyridin-4-ylpropanamide
CID 30157880
2-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168609116
(2S)-2-amino-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide;hydrochloride
CID 119303606
1-[4-[3-(4-fluorophenyl)propanoyl]-1,4-diazepan-1-yl]-3-methylbutan-1-one
CID 110797362
1-(3-hydroxypropyl)-3-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]urea
CID 60577432

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide (CID 110633755) is 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide is O=C(CCc1ccc(F)cc1)Nc1ccc(CCC(=O)N2CCCC2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide?
The InChIKey is QWYHLPGNAXQYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O2/c23-19-9-3-17(4-10-19)7-13-21(26)24-20-11-5-18(6-12-20)8-14-22(27)25-15-1-2-16-25/h3-6,9-12H,1-2,7-8,13-16H2,(H,24,26).
What are the key properties of 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide?
3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide has a molecular weight of 368.45 g/mol, XLogP of 3.95, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide is sourced from PubChem (CID 110633755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).