5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide

C19H21N3O2 — CID 120636503

IUPAC5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CC(C)N(c2ccccc2)C1=O
InChIInChI=1S/C19H21N3O2/c1-12-8-9-14(20)11-16(12)18(23)21-17-10-13(2)22(19(17)24)15-6-4-3-5-7-15/h3-9,11,13,17H,10,20H2,1-2H3,(H,21,23)
InChIKeyOXERELMXFFCWSE-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.50
Rot. Bonds3

About 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide

5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide (PubChem CID 120636503) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide
PubChem CID120636503
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCc1ccc(N)cc1C(=O)NC1CC(C)N(c2ccccc2)C1=O
InChIInChI=1S/C19H21N3O2/c1-12-8-9-14(20)11-16(12)18(23)21-17-10-13(2)22(19(17)24)15-6-4-3-5-7-15/h3-9,11,13,17H,10,20H2,1-2H3,(H,21,23)
InChIKeyOXERELMXFFCWSE-UHFFFAOYSA-N
XLogP2.50
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 146085997
(2R)-2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119336526
3-methyl-N-[(3S,5R)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]triazole-4-carboxamide
CID 124873611
3-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide;hydrochloride
CID 119336507
cis-(1S,3R)-2,2-dimethyl-3-[(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 122065674
3-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)but-2-enamide
CID 71998925
1-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)cyclopentane-1-carboxamide
CID 119336522
N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride
CID 119336511
3-(2-aminophenyl)-N-[(3S,5S)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]propanamide
CID 125120172
2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668914
2-(2-aminoethyl)-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 120636505
2-(1,3-dioxan-2-yl)-N-[(3S,5S)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 124626029

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The IUPAC name of 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide (CID 120636503) is 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide.
What is the SMILES notation for 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The canonical SMILES for 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide is Cc1ccc(N)cc1C(=O)NC1CC(C)N(c2ccccc2)C1=O.
What is the InChIKey of 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The InChIKey is OXERELMXFFCWSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-12-8-9-14(20)11-16(12)18(23)21-17-10-13(2)22(19(17)24)15-6-4-3-5-7-15/h3-9,11,13,17H,10,20H2,1-2H3,(H,21,23).
What are the key properties of 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide has a molecular weight of 323.40 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)benzamide is sourced from PubChem (CID 120636503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).