N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide

C19H24N2O4S — CID 38765461

IUPACN-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(NC(=O)CC(C)(C)C)c2)cc1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)13-18(22)20-15-6-5-7-17(12-15)26(23,24)21-14-8-10-16(25-4)11-9-14/h5-12,21H,13H2,1-4H3,(H,20,22)
InChIKeyGHHIUGKXGQKKEY-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.87
Rot. Bonds6

About N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide

N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide (PubChem CID 38765461) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide
PubChem CID38765461
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(NC(=O)CC(C)(C)C)c2)cc1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)13-18(22)20-15-6-5-7-17(12-15)26(23,24)21-14-8-10-16(25-4)11-9-14/h5-12,21H,13H2,1-4H3,(H,20,22)
InChIKeyGHHIUGKXGQKKEY-UHFFFAOYSA-N
XLogP3.87
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(carbamoylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 18168699
2-cyclopentyl-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 9414196
ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate
CID 7908123
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 4213453
1-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-propylurea
CID 4803273
3-methoxy-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 5156929
4-(4-chlorophenyl)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-oxobutanamide
CID 3595670
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide
CID 24639796
4-(2,5-dimethylthiophen-3-yl)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-oxobutanamide
CID 24639800
N-[3-(tert-butylsulfamoyl)phenyl]-2-(4-methoxyphenoxy)acetamide
CID 9108432
2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 21175305
3-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]sulfamoyl]benzoic acid
CID 2414183

Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide?
The IUPAC name of N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide (CID 38765461) is N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide.
What is the SMILES notation for N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide?
The canonical SMILES for N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide is COc1ccc(NS(=O)(=O)c2cccc(NC(=O)CC(C)(C)C)c2)cc1.
What is the InChIKey of N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide?
The InChIKey is GHHIUGKXGQKKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-19(2,3)13-18(22)20-15-6-5-7-17(12-15)26(23,24)21-14-8-10-16(25-4)11-9-14/h5-12,21H,13H2,1-4H3,(H,20,22).
What are the key properties of N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide?
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide has a molecular weight of 376.48 g/mol, XLogP of 3.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 38765461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).