N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide

C18H18N2O2 — CID 144706078

IUPACN-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide
SMILESCc1ccc(C2CC(=O)N(NC(=O)c3ccccc3)C2)cc1
InChIInChI=1S/C18H18N2O2/c1-13-7-9-14(10-8-13)16-11-17(21)20(12-16)19-18(22)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H,19,22)
InChIKeyGXKCTEWLXCUBFP-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.66
Rot. Bonds3

About N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide

N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide (PubChem CID 144706078) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide.

Molecular Properties

Compound NameN-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide
PubChem CID144706078
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide
SMILESCc1ccc(C2CC(=O)N(NC(=O)c3ccccc3)C2)cc1
InChIInChI=1S/C18H18N2O2/c1-13-7-9-14(10-8-13)16-11-17(21)20(12-16)19-18(22)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H,19,22)
InChIKeyGXKCTEWLXCUBFP-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxopyrrolidin-1-yl]benzamide
CID 144706065
1-methyl-4-(4-methylphenyl)pyrrolidin-2-one
CID 71364641
[2-(3,5-dimethylanilino)-2-oxoethyl] (3S)-1-benzamido-5-oxopyrrolidine-3-carboxylate
CID 9166626
[2-(4-methylphenyl)-2-oxoethyl] (3R)-1-[(4-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate
CID 7281773
[2-(4-methylphenyl)-2-oxoethyl] (3R)-1-[(3-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate
CID 7281797
[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl] (3R)-1-[(3-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate
CID 7281807
phenacyl 1-benzamido-5-oxopyrrolidine-3-carboxylate
CID 4272230
1-[(2-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylic acid
CID 3329799
1-[(4-methylphenyl)methyl]-4-phenylpyrrolidin-2-one
CID 155799488
[2-(2-ethylanilino)-2-oxoethyl] (3R)-1-[(4-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate
CID 9169237
N-(1-methyl-5-oxopyrrolidin-3-yl)benzamide
CID 110736486
[2-(4-fluorophenyl)-2-oxoethyl] (3R)-1-[(4-methylbenzoyl)amino]-5-oxopyrrolidine-3-carboxylate
CID 7281777

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide?
The IUPAC name of N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide (CID 144706078) is N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide.
What is the SMILES notation for N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide?
The canonical SMILES for N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide is Cc1ccc(C2CC(=O)N(NC(=O)c3ccccc3)C2)cc1.
What is the InChIKey of N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide?
The InChIKey is GXKCTEWLXCUBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-13-7-9-14(10-8-13)16-11-17(21)20(12-16)19-18(22)15-5-3-2-4-6-15/h2-10,16H,11-12H2,1H3,(H,19,22).
What are the key properties of N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide?
N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide has a molecular weight of 294.35 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylphenyl)-2-oxopyrrolidin-1-yl]benzamide is sourced from PubChem (CID 144706078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).