(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide

C19H18N2O3 — CID 7343636

IUPAC(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1C[C@H](C(=O)Nc2cccc(C(=O)c3ccccc3)c2)CC1=O
InChIInChI=1S/C19H18N2O3/c1-21-12-15(11-17(21)22)19(24)20-16-9-5-8-14(10-16)18(23)13-6-3-2-4-7-13/h2-10,15H,11-12H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeySFNRJLSYBUUSAM-OAHLLOKOSA-N
MW322.36 g/mol
LogP2.33
Rot. Bonds4

About (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide

(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 7343636) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
PubChem CID7343636
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1C[C@H](C(=O)Nc2cccc(C(=O)c3ccccc3)c2)CC1=O
InChIInChI=1S/C19H18N2O3/c1-21-12-15(11-17(21)22)19(24)20-16-9-5-8-14(10-16)18(23)13-6-3-2-4-7-13/h2-10,15H,11-12H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeySFNRJLSYBUUSAM-OAHLLOKOSA-N
XLogP2.33
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(3S)-1-(2-methylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoic acid
CID 9056299
(3R)-N-(3-acetylphenyl)-1-cyclopropyl-5-oxopyrrolidine-3-carboxamide
CID 39954335
(3S)-N-[3-(methylcarbamoyl)phenyl]-5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxamide
CID 51881813
3-[[(3R)-1-(3,5-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoic acid
CID 9005196
N-(3-acetylphenyl)-1-(3-methoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 113182587
(3R)-N-(3-chloro-4-fluorophenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 7357016
1-methyl-5-oxo-N-quinolin-3-ylpyrrolidine-3-carboxamide
CID 43926673
3-[[1-(4-methylcyclohexyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoic acid
CID 119219560
3-[[(3R)-1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoic acid
CID 9056341
N-(3-ethyl-4-fluorophenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 146125472
methyl 3-[[1-(2-methoxyethyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 108805610
3-[[(3R)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 9004553

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide (CID 7343636) is (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide is CN1C[C@H](C(=O)Nc2cccc(C(=O)c3ccccc3)c2)CC1=O.
What is the InChIKey of (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is SFNRJLSYBUUSAM-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-21-12-15(11-17(21)22)19(24)20-16-9-5-8-14(10-16)18(23)13-6-3-2-4-7-13/h2-10,15H,11-12H2,1H3,(H,20,24)/t15-/m1/s1.
What are the key properties of (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide?
(3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-benzoylphenyl)-1-methyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 7343636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).