3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide

C20H21N3O3 — CID 46471677

IUPAC3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCC(=O)Nc1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)ccc1C
InChIInChI=1S/C20H21N3O3/c1-13-8-9-15(11-18(13)21-14(2)24)20(26)22-16-5-3-6-17(12-16)23-10-4-7-19(23)25/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyZMVUSDYDZISBIX-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.33
Rot. Bonds4

About 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide

3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide (PubChem CID 46471677) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
PubChem CID46471677
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCC(=O)Nc1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)ccc1C
InChIInChI=1S/C20H21N3O3/c1-13-8-9-15(11-18(13)21-14(2)24)20(26)22-16-5-3-6-17(12-16)23-10-4-7-19(23)25/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyZMVUSDYDZISBIX-UHFFFAOYSA-N
XLogP3.33
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-iodo-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 9050034
N-(3-hydroxyphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 78816654
4-[(S)-methylsulfinyl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 25472925
N-[3-(2-oxopyrrolidin-1-yl)phenyl]-4-(trifluoromethylsulfanyl)benzamide
CID 8589872
N-[5-(3,5-dimethylpiperidine-1-carbonyl)-2-methylphenyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 55895253
3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-N-propylbenzamide
CID 55705699
3,4-dimethoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687664
N-(4-carbamoylphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 35133090
4-butyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 8589902
4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 24608350
5-amino-2-methyl-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 120622526
3-methoxy-N-[3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687642

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The IUPAC name of 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide (CID 46471677) is 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide is CC(=O)Nc1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)ccc1C.
What is the InChIKey of 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The InChIKey is ZMVUSDYDZISBIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-13-8-9-15(11-18(13)21-14(2)24)20(26)22-16-5-3-6-17(12-16)23-10-4-7-19(23)25/h3,5-6,8-9,11-12H,4,7,10H2,1-2H3,(H,21,24)(H,22,26).
What are the key properties of 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide has a molecular weight of 351.41 g/mol, XLogP of 3.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 46471677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).