N-ethyl-N-methylpropane-1-sulfonamide

C6H15NO2S — CID 59555461

IUPACN-ethyl-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC
InChIInChI=1S/C6H15NO2S/c1-4-6-10(8,9)7(3)5-2/h4-6H2,1-3H3
InChIKeySRUCEKSNOVWVOD-UHFFFAOYSA-N
MW165.26 g/mol
LogP0.68
Rot. Bonds4

About N-ethyl-N-methylpropane-1-sulfonamide

N-ethyl-N-methylpropane-1-sulfonamide (PubChem CID 59555461) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N-ethyl-N-methylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-methylpropane-1-sulfonamide
PubChem CID59555461
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN-ethyl-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC
InChIInChI=1S/C6H15NO2S/c1-4-6-10(8,9)7(3)5-2/h4-6H2,1-3H3
InChIKeySRUCEKSNOVWVOD-UHFFFAOYSA-N
XLogP0.68
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methylpropane-1-sulfonamide?
The IUPAC name of N-ethyl-N-methylpropane-1-sulfonamide (CID 59555461) is N-ethyl-N-methylpropane-1-sulfonamide.
What is the SMILES notation for N-ethyl-N-methylpropane-1-sulfonamide?
The canonical SMILES for N-ethyl-N-methylpropane-1-sulfonamide is CCCS(=O)(=O)N(C)CC.
What is the InChIKey of N-ethyl-N-methylpropane-1-sulfonamide?
The InChIKey is SRUCEKSNOVWVOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-4-6-10(8,9)7(3)5-2/h4-6H2,1-3H3.
What are the key properties of N-ethyl-N-methylpropane-1-sulfonamide?
N-ethyl-N-methylpropane-1-sulfonamide has a molecular weight of 165.26 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylpropane-1-sulfonamide is sourced from PubChem (CID 59555461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).