N-ethylbutane-2-sulfonamide

C6H15NO2S — CID 19014043

IUPACN-ethylbutane-2-sulfonamide
SMILESCCNS(=O)(=O)C(C)CC
InChIInChI=1S/C6H15NO2S/c1-4-6(3)10(8,9)7-5-2/h6-7H,4-5H2,1-3H3
InChIKeyGKEYUCDNCKJZNE-UHFFFAOYSA-N
MW165.26 g/mol
LogP0.72
Rot. Bonds4

About N-ethylbutane-2-sulfonamide

N-ethylbutane-2-sulfonamide (PubChem CID 19014043) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N-ethylbutane-2-sulfonamide.

Molecular Properties

Compound NameN-ethylbutane-2-sulfonamide
PubChem CID19014043
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN-ethylbutane-2-sulfonamide
SMILESCCNS(=O)(=O)C(C)CC
InChIInChI=1S/C6H15NO2S/c1-4-6(3)10(8,9)7-5-2/h6-7H,4-5H2,1-3H3
InChIKeyGKEYUCDNCKJZNE-UHFFFAOYSA-N
XLogP0.72
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethylbutane-2-sulfonamide?
The IUPAC name of N-ethylbutane-2-sulfonamide (CID 19014043) is N-ethylbutane-2-sulfonamide.
What is the SMILES notation for N-ethylbutane-2-sulfonamide?
The canonical SMILES for N-ethylbutane-2-sulfonamide is CCNS(=O)(=O)C(C)CC.
What is the InChIKey of N-ethylbutane-2-sulfonamide?
The InChIKey is GKEYUCDNCKJZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-4-6(3)10(8,9)7-5-2/h6-7H,4-5H2,1-3H3.
What are the key properties of N-ethylbutane-2-sulfonamide?
N-ethylbutane-2-sulfonamide has a molecular weight of 165.26 g/mol, XLogP of 0.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylbutane-2-sulfonamide is sourced from PubChem (CID 19014043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).