N,2-dimethylpropane-1-sulfonamide

C5H13NO2S — CID 15678707

IUPACN,2-dimethylpropane-1-sulfonamide
SMILESCNS(=O)(=O)CC(C)C
InChIInChI=1S/C5H13NO2S/c1-5(2)4-9(7,8)6-3/h5-6H,4H2,1-3H3
InChIKeyOMHBAVUWXIFNAS-UHFFFAOYSA-N
MW151.23 g/mol
LogP0.19
Rot. Bonds3

About N,2-dimethylpropane-1-sulfonamide

N,2-dimethylpropane-1-sulfonamide (PubChem CID 15678707) has the molecular formula C5H13NO2S and a molecular weight of 151.23 g/mol. Its IUPAC name is N,2-dimethylpropane-1-sulfonamide.

Molecular Properties

Compound NameN,2-dimethylpropane-1-sulfonamide
PubChem CID15678707
Molecular FormulaC5H13NO2S
Molecular Weight151.23 g/mol
Exact Mass151.07
IUPAC NameN,2-dimethylpropane-1-sulfonamide
SMILESCNS(=O)(=O)CC(C)C
InChIInChI=1S/C5H13NO2S/c1-5(2)4-9(7,8)6-3/h5-6H,4H2,1-3H3
InChIKeyOMHBAVUWXIFNAS-UHFFFAOYSA-N
XLogP0.19
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethylpropane-1-sulfonamide?
The IUPAC name of N,2-dimethylpropane-1-sulfonamide (CID 15678707) is N,2-dimethylpropane-1-sulfonamide.
What is the SMILES notation for N,2-dimethylpropane-1-sulfonamide?
The canonical SMILES for N,2-dimethylpropane-1-sulfonamide is CNS(=O)(=O)CC(C)C.
What is the InChIKey of N,2-dimethylpropane-1-sulfonamide?
The InChIKey is OMHBAVUWXIFNAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2S/c1-5(2)4-9(7,8)6-3/h5-6H,4H2,1-3H3.
What are the key properties of N,2-dimethylpropane-1-sulfonamide?
N,2-dimethylpropane-1-sulfonamide has a molecular weight of 151.23 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylpropane-1-sulfonamide is sourced from PubChem (CID 15678707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).