ethane;methane;N-methylbenzenesulfonamide

C10H19NO2S — CID 159487495

IUPACethane;methane;N-methylbenzenesulfonamide
SMILESC.CC.CNS(=O)(=O)c1ccccc1
InChIInChI=1S/C7H9NO2S.C2H6.CH4/c1-8-11(9,10)7-5-3-2-4-6-7;1-2;/h2-6,8H,1H3;1-2H3;1H4
InChIKeyLXTLYZHBUQKYGD-UHFFFAOYSA-N
MW217.33 g/mol
LogP2.26
Rot. Bonds2

About ethane;methane;N-methylbenzenesulfonamide

ethane;methane;N-methylbenzenesulfonamide (PubChem CID 159487495) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is ethane;methane;N-methylbenzenesulfonamide.

Molecular Properties

Compound Nameethane;methane;N-methylbenzenesulfonamide
PubChem CID159487495
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC Nameethane;methane;N-methylbenzenesulfonamide
SMILESC.CC.CNS(=O)(=O)c1ccccc1
InChIInChI=1S/C7H9NO2S.C2H6.CH4/c1-8-11(9,10)7-5-3-2-4-6-7;1-2;/h2-6,8H,1H3;1-2H3;1H4
InChIKeyLXTLYZHBUQKYGD-UHFFFAOYSA-N
XLogP2.26
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

benzyl-dimethyl-phenylazanium;N-methylbenzenesulfonamide
CID 158280151
4-[(benzylamino)methyl]-N-methylbenzenesulfonamide
CID 139319386
N,3-dimethylbenzenesulfonamide;ethane
CID 143402177
4-(2-chlorophenyl)-N-methylbenzenesulfonamide
CID 174761183
N-(benzenesulfonyl)benzenesulfonamide;silver
CID 175421278
N-methyl-4-(methylamino)benzenesulfonamide
CID 15049669
ethane;4-(2-ethylphenoxy)-N-methylbenzenesulfonamide
CID 91006341
CID 88793655
CID 88793655
3-hydroxy-N-methylbenzenesulfonamide
CID 20621554
N-methyl-3-(methylamino)benzenesulfonamide
CID 63089854
potassium 4-chloro-N-methylbenzenesulfonamide
CID 21293199
N-methyl-4-phenacylbenzenesulfonamide
CID 63199150

Frequently Asked Questions

What is the IUPAC name of ethane;methane;N-methylbenzenesulfonamide?
The IUPAC name of ethane;methane;N-methylbenzenesulfonamide (CID 159487495) is ethane;methane;N-methylbenzenesulfonamide.
What is the SMILES notation for ethane;methane;N-methylbenzenesulfonamide?
The canonical SMILES for ethane;methane;N-methylbenzenesulfonamide is C.CC.CNS(=O)(=O)c1ccccc1.
What is the InChIKey of ethane;methane;N-methylbenzenesulfonamide?
The InChIKey is LXTLYZHBUQKYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2S.C2H6.CH4/c1-8-11(9,10)7-5-3-2-4-6-7;1-2;/h2-6,8H,1H3;1-2H3;1H4.
What are the key properties of ethane;methane;N-methylbenzenesulfonamide?
ethane;methane;N-methylbenzenesulfonamide has a molecular weight of 217.33 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;N-methylbenzenesulfonamide is sourced from PubChem (CID 159487495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).