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

C19H21N3O4S — CID 92673482

IUPAC3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H21N3O4S/c1-13-16(5-3-6-17(13)21-27(2,25)26)19(24)20-14-8-10-15(11-9-14)22-12-4-7-18(22)23/h3,5-6,8-11,21H,4,7,12H2,1-2H3,(H,20,24)
InChIKeyMCNPPWHJMHMUHC-UHFFFAOYSA-N
MW387.46 g/mol
LogP2.75
Rot. Bonds5

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

3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (PubChem CID 92673482) has the molecular formula C19H21N3O4S and a molecular weight of 387.46 g/mol. Its IUPAC name is 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
PubChem CID92673482
Molecular FormulaC19H21N3O4S
Molecular Weight387.46 g/mol
Exact Mass387.13
IUPAC Name3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
SMILESCc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H21N3O4S/c1-13-16(5-3-6-17(13)21-27(2,25)26)19(24)20-14-8-10-15(11-9-14)22-12-4-7-18(22)23/h3,5-6,8-11,21H,4,7,12H2,1-2H3,(H,20,24)
InChIKeyMCNPPWHJMHMUHC-UHFFFAOYSA-N
XLogP2.75
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-chlorophenyl)sulfonylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 35893819
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-propylsulfonylbenzamide
CID 39942601
3-methyl-2-nitro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 39902627
2-methoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686423
N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
CID 7687294
2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-5-pyrrolidin-1-ylsulfonylbenzamide
CID 27838215
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
2-methyl-3-[(4-methylphenyl)sulfonylamino]-N-(4-piperidin-1-ylphenyl)benzamide
CID 100512380
4-methyl-3-[(4-methylphenyl)sulfonylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 92685963
4-acetamido-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 78788340
2,3-dimethyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 42140218

Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The IUPAC name of 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide (CID 92673482) is 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The canonical SMILES for 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is Cc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
The InChIKey is MCNPPWHJMHMUHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4S/c1-13-16(5-3-6-17(13)21-27(2,25)26)19(24)20-14-8-10-15(11-9-14)22-12-4-7-18(22)23/h3,5-6,8-11,21H,4,7,12H2,1-2H3,(H,20,24).
What are the key properties of 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide?
3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide has a molecular weight of 387.46 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-2-methyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 92673482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).