2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide

C19H24N2O3S — CID 42940924

IUPAC2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
SMILESCCC(C)C(=O)Nc1ccc(C)c(S(=O)(=O)Nc2cccc(C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-5-14(3)19(22)20-16-10-9-15(4)18(12-16)25(23,24)21-17-8-6-7-13(2)11-17/h6-12,14,21H,5H2,1-4H3,(H,20,22)
InChIKeyCDNVEMDTUFGKFR-UHFFFAOYSA-N
MW360.48 g/mol
LogP4.09
Rot. Bonds6

About 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide

2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide (PubChem CID 42940924) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide.

Molecular Properties

Compound Name2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
PubChem CID42940924
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
SMILESCCC(C)C(=O)Nc1ccc(C)c(S(=O)(=O)Nc2cccc(C)c2)c1
InChIInChI=1S/C19H24N2O3S/c1-5-14(3)19(22)20-16-10-9-15(4)18(12-16)25(23,24)21-17-8-6-7-13(2)11-17/h6-12,14,21H,5H2,1-4H3,(H,20,22)
InChIKeyCDNVEMDTUFGKFR-UHFFFAOYSA-N
XLogP4.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
CID 35678664
2-methyl-3-(methylamino)-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]propanamide;hydrochloride
CID 119679343
(2S)-2-amino-4-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]pentanamide;hydrochloride
CID 119679357
(2S)-2-amino-3,3-dimethyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
CID 119679340
4-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]pentanamide
CID 25342400
4-amino-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]pentanamide;hydrochloride
CID 120558919
(2R)-N-[3-[(2-chlorophenyl)sulfamoyl]-4-methylphenyl]-2-methylbutanamide
CID 35560710
2-methyl-N-(4-methyl-3-sulfamoylphenyl)butanamide
CID 51331861
(2S)-2-methoxy-3-methyl-N-[3-methyl-4-[(3-methylphenyl)sulfamoyl]phenyl]butanamide
CID 170343253
N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]-2-(trifluoromethylsulfanyl)acetamide
CID 39908102
N-[3-[(4-bromophenyl)sulfamoyl]-4-methylphenyl]-2-methylpropanamide
CID 25342391
N-[3-[(4-bromophenyl)sulfamoyl]-4-methylphenyl]-2-(carbamoylamino)-3-methylpentanamide
CID 24636258

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide?
The IUPAC name of 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide (CID 42940924) is 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide.
What is the SMILES notation for 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide?
The canonical SMILES for 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide is CCC(C)C(=O)Nc1ccc(C)c(S(=O)(=O)Nc2cccc(C)c2)c1.
What is the InChIKey of 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide?
The InChIKey is CDNVEMDTUFGKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-5-14(3)19(22)20-16-10-9-15(4)18(12-16)25(23,24)21-17-8-6-7-13(2)11-17/h6-12,14,21H,5H2,1-4H3,(H,20,22).
What are the key properties of 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide?
2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide has a molecular weight of 360.48 g/mol, XLogP of 4.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]butanamide is sourced from PubChem (CID 42940924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).