2-(dimethylsulfamoylamino)-1,4-dimethylbenzene

C10H16N2O2S — CID 3889138

IUPAC2-(dimethylsulfamoylamino)-1,4-dimethylbenzene
SMILESCc1ccc(C)c(NS(=O)(=O)N(C)C)c1
InChIInChI=1S/C10H16N2O2S/c1-8-5-6-9(2)10(7-8)11-15(13,14)12(3)4/h5-7,11H,1-4H3
InChIKeyGWSQHQUVTXTLFA-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.52
Rot. Bonds3

About 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene

2-(dimethylsulfamoylamino)-1,4-dimethylbenzene (PubChem CID 3889138) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene.

Molecular Properties

Compound Name2-(dimethylsulfamoylamino)-1,4-dimethylbenzene
PubChem CID3889138
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name2-(dimethylsulfamoylamino)-1,4-dimethylbenzene
SMILESCc1ccc(C)c(NS(=O)(=O)N(C)C)c1
InChIInChI=1S/C10H16N2O2S/c1-8-5-6-9(2)10(7-8)11-15(13,14)12(3)4/h5-7,11H,1-4H3
InChIKeyGWSQHQUVTXTLFA-UHFFFAOYSA-N
XLogP1.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-(dimethylsulfamoylamino)-1-methylbenzene
CID 4635582
3-(dimethylsulfamoylamino)-4-methylbenzoic acid
CID 28788003
N-(2,5-dimethylphenyl)ethanesulfonamide
CID 902936
N-(2,5-dimethylphenyl)propane-2-sulfonamide
CID 62997790
methyl 2-(dimethylsulfamoylamino)-5-methylbenzoate
CID 43624406
N-(2,5-dimethylphenyl)-3-methylbenzenesulfonamide
CID 47104321
1-amino-2-(diethylsulfamoylamino)-4-methylbenzene
CID 112557490
4-bromo-N-(2,5-dimethylphenyl)benzenesulfonamide
CID 4517500
2-bromo-4-(dimethylsulfamoylamino)-1-methylbenzene
CID 63334388
N-chloro-2,5-dimethylaniline
CID 141218472
4-bromo-N-(2,5-dimethylphenyl)-2,5-dimethylbenzenesulfonamide
CID 146095930
4-(dimethylsulfamoylamino)-3-methylbenzoic acid
CID 28787969

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene?
The IUPAC name of 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene (CID 3889138) is 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene.
What is the SMILES notation for 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene?
The canonical SMILES for 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene is Cc1ccc(C)c(NS(=O)(=O)N(C)C)c1.
What is the InChIKey of 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene?
The InChIKey is GWSQHQUVTXTLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-8-5-6-9(2)10(7-8)11-15(13,14)12(3)4/h5-7,11H,1-4H3.
What are the key properties of 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene?
2-(dimethylsulfamoylamino)-1,4-dimethylbenzene has a molecular weight of 228.32 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylsulfamoylamino)-1,4-dimethylbenzene is sourced from PubChem (CID 3889138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).