1-acetyl-2-(dimethylsulfamoylamino)benzene

C10H14N2O3S — CID 28788463

IUPAC1-acetyl-2-(dimethylsulfamoylamino)benzene
SMILESCC(=O)c1ccccc1NS(=O)(=O)N(C)C
InChIInChI=1S/C10H14N2O3S/c1-8(13)9-6-4-5-7-10(9)11-16(14,15)12(2)3/h4-7,11H,1-3H3
InChIKeyDBAMCNHLCRXHGA-UHFFFAOYSA-N
MW242.30 g/mol
LogP1.11
Rot. Bonds4

About 1-acetyl-2-(dimethylsulfamoylamino)benzene

1-acetyl-2-(dimethylsulfamoylamino)benzene (PubChem CID 28788463) has the molecular formula C10H14N2O3S and a molecular weight of 242.30 g/mol. Its IUPAC name is 1-acetyl-2-(dimethylsulfamoylamino)benzene.

Molecular Properties

Compound Name1-acetyl-2-(dimethylsulfamoylamino)benzene
PubChem CID28788463
Molecular FormulaC10H14N2O3S
Molecular Weight242.30 g/mol
Exact Mass242.07
IUPAC Name1-acetyl-2-(dimethylsulfamoylamino)benzene
SMILESCC(=O)c1ccccc1NS(=O)(=O)N(C)C
InChIInChI=1S/C10H14N2O3S/c1-8(13)9-6-4-5-7-10(9)11-16(14,15)12(2)3/h4-7,11H,1-3H3
InChIKeyDBAMCNHLCRXHGA-UHFFFAOYSA-N
XLogP1.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

propan-2-yl 2-(dimethylsulfamoylamino)benzoate
CID 133062998
2-(dimethylsulfamoylamino)benzenecarbothioamide
CID 28788437
3-(dimethylsulfamoylamino)naphthalene-2-carboxylic acid
CID 28788057
5-bromo-2-(dimethylsulfamoylamino)benzoic acid
CID 55031300
methyl 2-[4-(dimethylsulfamoylamino)anilino]benzoate
CID 112988468
N-(2-acetylphenyl)-3-methylbenzenesulfonamide
CID 24694730
3-[4-[(2-acetylphenyl)sulfamoyl]phenyl]prop-2-enoic acid
CID 4237126
N-(2-acetylphenyl)-2,3,4-trifluorobenzenesulfonamide
CID 2442571
N-(2-acetylphenyl)-3-fluorobenzenesulfonamide
CID 2526444
4-acetyl-1-chloro-2-(dimethylsulfamoylamino)benzene
CID 18615256
1-(dimethylsulfamoylamino)-2-propan-2-ylsulfanylbenzene
CID 71851414
1-(dimethylsulfamoylamino)-2-[1-(methylamino)ethyl]benzene
CID 43508162

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-2-(dimethylsulfamoylamino)benzene?
The IUPAC name of 1-acetyl-2-(dimethylsulfamoylamino)benzene (CID 28788463) is 1-acetyl-2-(dimethylsulfamoylamino)benzene.
What is the SMILES notation for 1-acetyl-2-(dimethylsulfamoylamino)benzene?
The canonical SMILES for 1-acetyl-2-(dimethylsulfamoylamino)benzene is CC(=O)c1ccccc1NS(=O)(=O)N(C)C.
What is the InChIKey of 1-acetyl-2-(dimethylsulfamoylamino)benzene?
The InChIKey is DBAMCNHLCRXHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S/c1-8(13)9-6-4-5-7-10(9)11-16(14,15)12(2)3/h4-7,11H,1-3H3.
What are the key properties of 1-acetyl-2-(dimethylsulfamoylamino)benzene?
1-acetyl-2-(dimethylsulfamoylamino)benzene has a molecular weight of 242.30 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-2-(dimethylsulfamoylamino)benzene is sourced from PubChem (CID 28788463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).