N,3-dimethyl-4-(sulfamoylamino)benzamide

C9H13N3O3S — CID 112573608

IUPACN,3-dimethyl-4-(sulfamoylamino)benzamide
SMILESCNC(=O)c1ccc(NS(N)(=O)=O)c(C)c1
InChIInChI=1S/C9H13N3O3S/c1-6-5-7(9(13)11-2)3-4-8(6)12-16(10,14)15/h3-5,12H,1-2H3,(H,11,13)(H2,10,14,15)
InChIKeyKAUFYOBCWWRSEQ-UHFFFAOYSA-N
MW243.29 g/mol
LogP-0.03
Rot. Bonds3

About N,3-dimethyl-4-(sulfamoylamino)benzamide

N,3-dimethyl-4-(sulfamoylamino)benzamide (PubChem CID 112573608) has the molecular formula C9H13N3O3S and a molecular weight of 243.29 g/mol. Its IUPAC name is N,3-dimethyl-4-(sulfamoylamino)benzamide.

Molecular Properties

Compound NameN,3-dimethyl-4-(sulfamoylamino)benzamide
PubChem CID112573608
Molecular FormulaC9H13N3O3S
Molecular Weight243.29 g/mol
Exact Mass243.07
IUPAC NameN,3-dimethyl-4-(sulfamoylamino)benzamide
SMILESCNC(=O)c1ccc(NS(N)(=O)=O)c(C)c1
InChIInChI=1S/C9H13N3O3S/c1-6-5-7(9(13)11-2)3-4-8(6)12-16(10,14)15/h3-5,12H,1-2H3,(H,11,13)(H2,10,14,15)
InChIKeyKAUFYOBCWWRSEQ-UHFFFAOYSA-N
XLogP-0.03
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.29
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,3-dimethyl-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 41465640
4-[[2-methyl-4-(methylcarbamoyl)phenyl]sulfamoyl]butanoic acid
CID 43699845
N,3-dimethyl-4-(1-methylsulfonylpropan-2-ylamino)benzamide
CID 64630962
4-(2,2-dimethylpropanoylamino)-N,3-dimethylbenzamide
CID 61215739
4-chloro-3-[(2,4-dimethylphenyl)sulfamoyl]-N-methylbenzamide
CID 3680171
4-[2-methyl-4-(methylcarbamoyl)anilino]-4-oxobutanoic acid
CID 54868212
N,4-dimethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 3581351
4-(butanoylamino)-N,3-dimethylbenzamide
CID 61216786
4-[(2,6-dimethylphenyl)methylamino]-N,3-dimethylbenzamide
CID 78997216
4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide
CID 47307868
N,4-dimethyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 19062594
4-[(2-chlorobenzoyl)amino]-N,3-dimethylbenzamide
CID 131930892

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-(sulfamoylamino)benzamide?
The IUPAC name of N,3-dimethyl-4-(sulfamoylamino)benzamide (CID 112573608) is N,3-dimethyl-4-(sulfamoylamino)benzamide.
What is the SMILES notation for N,3-dimethyl-4-(sulfamoylamino)benzamide?
The canonical SMILES for N,3-dimethyl-4-(sulfamoylamino)benzamide is CNC(=O)c1ccc(NS(N)(=O)=O)c(C)c1.
What is the InChIKey of N,3-dimethyl-4-(sulfamoylamino)benzamide?
The InChIKey is KAUFYOBCWWRSEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3S/c1-6-5-7(9(13)11-2)3-4-8(6)12-16(10,14)15/h3-5,12H,1-2H3,(H,11,13)(H2,10,14,15).
What are the key properties of N,3-dimethyl-4-(sulfamoylamino)benzamide?
N,3-dimethyl-4-(sulfamoylamino)benzamide has a molecular weight of 243.29 g/mol, XLogP of -0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-(sulfamoylamino)benzamide is sourced from PubChem (CID 112573608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).