3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide

C20H21FN2O2 — CID 110737318

IUPAC3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide
SMILESO=C(CCc1cccc(F)c1)NCC1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C20H21FN2O2/c21-17-6-4-5-15(11-17)9-10-19(24)22-13-16-12-20(25)23(14-16)18-7-2-1-3-8-18/h1-8,11,16H,9-10,12-14H2,(H,22,24)
InChIKeyBRYNDVLJKYVZET-UHFFFAOYSA-N
MW340.40 g/mol
LogP2.93
Rot. Bonds6

About 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide

3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide (PubChem CID 110737318) has the molecular formula C20H21FN2O2 and a molecular weight of 340.40 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide
PubChem CID110737318
Molecular FormulaC20H21FN2O2
Molecular Weight340.40 g/mol
Exact Mass340.16
IUPAC Name3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide
SMILESO=C(CCc1cccc(F)c1)NCC1CC(=O)N(c2ccccc2)C1
InChIInChI=1S/C20H21FN2O2/c21-17-6-4-5-15(11-17)9-10-19(24)22-13-16-12-20(25)23(14-16)18-7-2-1-3-8-18/h1-8,11,16H,9-10,12-14H2,(H,22,24)
InChIKeyBRYNDVLJKYVZET-UHFFFAOYSA-N
XLogP2.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-fluorophenyl)-N-[(5-oxo-1-propan-2-ylpyrrolidin-3-yl)methyl]propanamide
CID 110737248
N-[[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-2-phenylacetamide
CID 40895899
2-(3-chlorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 110737325
N-[[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-2-(3-methylphenyl)acetamide
CID 40895927
3-cyclopentyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide
CID 16918197
N-[[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-3-(4-methoxyphenyl)propanamide
CID 16918778
N-[[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-3,3-diphenylpropanamide
CID 16918752
(3S)-1-[4-[2-(3-fluorophenyl)ethyl]phenyl]-5-oxopyrrolidine-3-carboxylic acid
CID 68614672
2-(3-methylphenyl)-N-[[(3S)-1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]methyl]acetamide
CID 40897451
N-[[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]propanamide
CID 40805226
2-naphthalen-2-yloxy-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]acetamide
CID 16918271
N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-3-(3-methylphenyl)propanamide
CID 110719902

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide?
The IUPAC name of 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide (CID 110737318) is 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide.
What is the SMILES notation for 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide?
The canonical SMILES for 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide is O=C(CCc1cccc(F)c1)NCC1CC(=O)N(c2ccccc2)C1.
What is the InChIKey of 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide?
The InChIKey is BRYNDVLJKYVZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O2/c21-17-6-4-5-15(11-17)9-10-19(24)22-13-16-12-20(25)23(14-16)18-7-2-1-3-8-18/h1-8,11,16H,9-10,12-14H2,(H,22,24).
What are the key properties of 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide?
3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide has a molecular weight of 340.40 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]propanamide is sourced from PubChem (CID 110737318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).