N,N-dimethylbutane-1-sulfonamide

C6H15NO2S — CID 19684365

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

About N,N-dimethylbutane-1-sulfonamide

N,N-dimethylbutane-1-sulfonamide (PubChem CID 19684365) has the molecular formula C6H15NO2S and a molecular weight of 165.26 g/mol. Its IUPAC name is N,N-dimethylbutane-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethylbutane-1-sulfonamide
PubChem CID19684365
Molecular FormulaC6H15NO2S
Molecular Weight165.26 g/mol
Exact Mass165.08
IUPAC NameN,N-dimethylbutane-1-sulfonamide
SMILESCCCCS(=O)(=O)N(C)C
InChIInChI=1S/C6H15NO2S/c1-4-5-6-10(8,9)7(2)3/h4-6H2,1-3H3
InChIKeyVQONYTPEBWGVPD-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,N-dimethylbutane-1-sulfonamide?
The IUPAC name of N,N-dimethylbutane-1-sulfonamide (CID 19684365) is N,N-dimethylbutane-1-sulfonamide.
What is the SMILES notation for N,N-dimethylbutane-1-sulfonamide?
The canonical SMILES for N,N-dimethylbutane-1-sulfonamide is CCCCS(=O)(=O)N(C)C.
What is the InChIKey of N,N-dimethylbutane-1-sulfonamide?
The InChIKey is VQONYTPEBWGVPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2S/c1-4-5-6-10(8,9)7(2)3/h4-6H2,1-3H3.
What are the key properties of N,N-dimethylbutane-1-sulfonamide?
N,N-dimethylbutane-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,N-dimethylbutane-1-sulfonamide is sourced from PubChem (CID 19684365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).