1-cyclobutylpropane-1-sulfonamide

C7H15NO2S — CID 130655197

IUPAC1-cyclobutylpropane-1-sulfonamide
SMILESCCC(C1CCC1)S(N)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-2-7(11(8,9)10)6-4-3-5-6/h6-7H,2-5H2,1H3,(H2,8,9,10)
InChIKeyQZYVPVQXZCAVJJ-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.85
Rot. Bonds3

About 1-cyclobutylpropane-1-sulfonamide

1-cyclobutylpropane-1-sulfonamide (PubChem CID 130655197) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is 1-cyclobutylpropane-1-sulfonamide.

Molecular Properties

Compound Name1-cyclobutylpropane-1-sulfonamide
PubChem CID130655197
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC Name1-cyclobutylpropane-1-sulfonamide
SMILESCCC(C1CCC1)S(N)(=O)=O
InChIInChI=1S/C7H15NO2S/c1-2-7(11(8,9)10)6-4-3-5-6/h6-7H,2-5H2,1H3,(H2,8,9,10)
InChIKeyQZYVPVQXZCAVJJ-UHFFFAOYSA-N
XLogP0.85
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentylbutane-1-sulfonamide
CID 165443509
1-(oxolan-3-yl)propane-1-sulfonamide
CID 126976073
1-(3-aminocyclohexyl)propane-1-sulfonic acid
CID 22073446
(2S)-2-cyclohexyl-2-ethylsulfonylethanamine
CID 99991186
(2S)-2-cyclohexyl-2-ethylsulfonylethanol
CID 99991170
(1R,2R)-1-cyclobutyl-2-methylpent-4-ene-1-sulfonamide
CID 118910299
cyclohexyl(ethylsulfonyl)methanamine
CID 54085731
1-amino-1-cyclohexylpropane-2-sulfonamide
CID 174660320
3-cyclobutyl-2-methylpentan-2-amine
CID 137411422
2-(sulfamoylamino)butylcyclopropane
CID 112690847
1-cyclohexyl-3-ethylpentan-1-amine
CID 82920637
2-cyclopentyl-2-hydroxyethanesulfonamide
CID 115019545

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutylpropane-1-sulfonamide?
The IUPAC name of 1-cyclobutylpropane-1-sulfonamide (CID 130655197) is 1-cyclobutylpropane-1-sulfonamide.
What is the SMILES notation for 1-cyclobutylpropane-1-sulfonamide?
The canonical SMILES for 1-cyclobutylpropane-1-sulfonamide is CCC(C1CCC1)S(N)(=O)=O.
What is the InChIKey of 1-cyclobutylpropane-1-sulfonamide?
The InChIKey is QZYVPVQXZCAVJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-2-7(11(8,9)10)6-4-3-5-6/h6-7H,2-5H2,1H3,(H2,8,9,10).
What are the key properties of 1-cyclobutylpropane-1-sulfonamide?
1-cyclobutylpropane-1-sulfonamide has a molecular weight of 177.27 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutylpropane-1-sulfonamide is sourced from PubChem (CID 130655197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).