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

C20H22N2O3 — CID 136524772

IUPAC3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCCOc1cccc(C(=O)N(C)C2CCN(c3ccccc3)C2=O)c1
InChIInChI=1S/C20H22N2O3/c1-3-25-17-11-7-8-15(14-17)19(23)21(2)18-12-13-22(20(18)24)16-9-5-4-6-10-16/h4-11,14,18H,3,12-13H2,1-2H3
InChIKeyMCBNSWVDCFFIFY-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.96
Rot. Bonds5

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

3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide (PubChem CID 136524772) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide.

Molecular Properties

Compound Name3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
PubChem CID136524772
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide
SMILESCCOc1cccc(C(=O)N(C)C2CCN(c3ccccc3)C2=O)c1
InChIInChI=1S/C20H22N2O3/c1-3-25-17-11-7-8-15(14-17)19(23)21(2)18-12-13-22(20(18)24)16-9-5-4-6-10-16/h4-11,14,18H,3,12-13H2,1-2H3
InChIKeyMCBNSWVDCFFIFY-UHFFFAOYSA-N
XLogP2.96
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119319400
2-methoxy-N-methyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzamide
CID 95303783
3-ethoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 119443526
N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide
CID 95618514
1-[2-[methyl-(2-oxo-1-phenylpyrrolidin-3-yl)amino]-2-oxoethyl]pyrazole-4-carboxylic acid
CID 146136932
3-(2-methoxy-4-methylphenoxy)-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 86936136
2-(2-methoxyethylamino)-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)acetamide
CID 119776473
4-[ethyl-(2-oxo-1-phenylpyrrolidin-3-yl)carbamoyl]pyridine-2-carboxylic acid
CID 119184961
1-[3-[[(3-ethoxybenzoyl)-methylamino]methyl]phenyl]piperidine-4-carboxylic acid
CID 110495402
7-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)heptanamide
CID 119776437
2-(2-methoxyethylamino)-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)acetamide;hydrochloride
CID 119776472
N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]-1,3-benzodioxole-4-carboxamide
CID 95621378

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The IUPAC name of 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide (CID 136524772) is 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide.
What is the SMILES notation for 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The canonical SMILES for 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide is CCOc1cccc(C(=O)N(C)C2CCN(c3ccccc3)C2=O)c1.
What is the InChIKey of 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
The InChIKey is MCBNSWVDCFFIFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-3-25-17-11-7-8-15(14-17)19(23)21(2)18-12-13-22(20(18)24)16-9-5-4-6-10-16/h4-11,14,18H,3,12-13H2,1-2H3.
What are the key properties of 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide?
3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide has a molecular weight of 338.41 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzamide is sourced from PubChem (CID 136524772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).