N-methyl-N-(2-methylpropyl)propane-2-sulfonamide

C8H19NO2S — CID 18343503

IUPACN-methyl-N-(2-methylpropyl)propane-2-sulfonamide
SMILESCC(C)CN(C)S(=O)(=O)C(C)C
InChIInChI=1S/C8H19NO2S/c1-7(2)6-9(5)12(10,11)8(3)4/h7-8H,6H2,1-5H3
InChIKeyPZZVCOPBRAFVJB-UHFFFAOYSA-N
MW193.31 g/mol
LogP1.31
Rot. Bonds4

About N-methyl-N-(2-methylpropyl)propane-2-sulfonamide

N-methyl-N-(2-methylpropyl)propane-2-sulfonamide (PubChem CID 18343503) has the molecular formula C8H19NO2S and a molecular weight of 193.31 g/mol. Its IUPAC name is N-methyl-N-(2-methylpropyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylpropyl)propane-2-sulfonamide
PubChem CID18343503
Molecular FormulaC8H19NO2S
Molecular Weight193.31 g/mol
Exact Mass193.11
IUPAC NameN-methyl-N-(2-methylpropyl)propane-2-sulfonamide
SMILESCC(C)CN(C)S(=O)(=O)C(C)C
InChIInChI=1S/C8H19NO2S/c1-7(2)6-9(5)12(10,11)8(3)4/h7-8H,6H2,1-5H3
InChIKeyPZZVCOPBRAFVJB-UHFFFAOYSA-N
XLogP1.31
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dibutylethanesulfonamide
CID 303050
Methylsulphonamide, N-ethyl-N-isobutyl-
CID 60765389
Hydron;3-(trimethylazaniumyl)propane-1-sulfonate
CID 101248025
N-butyl-4,4,4-trifluoro-N-(2-methylpropyl)butane-1-sulfonamide
CID 89281471
N-butyl-3,3,3-trifluoro-N-(2-methylpropyl)propane-1-sulfonamide
CID 89281475
N,N-dipropylethanesulfonamide
CID 303053
N,N-diethylpentane-1-sulfonamide
CID 303054
N,N-dipropylpropane-1-sulfonamide
CID 303060
N,N-dibutylpropane-1-sulfonamide
CID 303061
N,N-dipropylbutane-1-sulfonamide
CID 303062
N,N-diethylpropane-1-sulfonamide
CID 303064
N,N-diethylbutane-1-sulfonamide
CID 304056

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylpropyl)propane-2-sulfonamide?
The IUPAC name of N-methyl-N-(2-methylpropyl)propane-2-sulfonamide (CID 18343503) is N-methyl-N-(2-methylpropyl)propane-2-sulfonamide.
What is the SMILES notation for N-methyl-N-(2-methylpropyl)propane-2-sulfonamide?
The canonical SMILES for N-methyl-N-(2-methylpropyl)propane-2-sulfonamide is CC(C)CN(C)S(=O)(=O)C(C)C.
What is the InChIKey of N-methyl-N-(2-methylpropyl)propane-2-sulfonamide?
The InChIKey is PZZVCOPBRAFVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2S/c1-7(2)6-9(5)12(10,11)8(3)4/h7-8H,6H2,1-5H3.
What are the key properties of N-methyl-N-(2-methylpropyl)propane-2-sulfonamide?
N-methyl-N-(2-methylpropyl)propane-2-sulfonamide has a molecular weight of 193.31 g/mol, XLogP of 1.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylpropyl)propane-2-sulfonamide is sourced from PubChem (CID 18343503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).