1-cyclohexyl-N-methylbutane-2-sulfonamide

C11H23NO2S — CID 165445824

IUPAC1-cyclohexyl-N-methylbutane-2-sulfonamide
SMILESCCC(CC1CCCCC1)S(=O)(=O)NC
InChIInChI=1S/C11H23NO2S/c1-3-11(15(13,14)12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3
InChIKeyRUZFAOQDDMPIKY-UHFFFAOYSA-N
MW233.38 g/mol
LogP2.28
Rot. Bonds5

About 1-cyclohexyl-N-methylbutane-2-sulfonamide

1-cyclohexyl-N-methylbutane-2-sulfonamide (PubChem CID 165445824) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is 1-cyclohexyl-N-methylbutane-2-sulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-methylbutane-2-sulfonamide
PubChem CID165445824
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC Name1-cyclohexyl-N-methylbutane-2-sulfonamide
SMILESCCC(CC1CCCCC1)S(=O)(=O)NC
InChIInChI=1S/C11H23NO2S/c1-3-11(15(13,14)12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3
InChIKeyRUZFAOQDDMPIKY-UHFFFAOYSA-N
XLogP2.28
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-cyclohexyl-2-methylsulfonylpropyl)cyclohexane
CID 158866728
1-cyclohexyl-N-methylbutan-2-amine
CID 62601734
azane;2-methylbutylcyclohexane
CID 143986613
(2R)-1-cyclohexylbutan-2-ol
CID 59949714
2-cyclohexyl-1-cyclopropyl-N-methylethanamine
CID 62600401
2-cyclohexyl-1-N'-methylethane-1,1-diamine
CID 139541919
(2R)-3-cyclohexyl-2-(propan-2-ylsulfonylamino)propanoic acid
CID 114264495
1-cycloheptyl-N-methyl-5-methylsulfonylpentan-2-amine
CID 115820359
1-(cyclopentylmethylsulfonyl)-N-methylbutan-2-amine
CID 64676293
bis(2-methylpropylcyclohexane);2-methylpropylcyclopentane
CID 159474199
2-cycloheptyl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115855813
N-cyclohexylbutane-2-sulfonamide
CID 59716186

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methylbutane-2-sulfonamide?
The IUPAC name of 1-cyclohexyl-N-methylbutane-2-sulfonamide (CID 165445824) is 1-cyclohexyl-N-methylbutane-2-sulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-methylbutane-2-sulfonamide?
The canonical SMILES for 1-cyclohexyl-N-methylbutane-2-sulfonamide is CCC(CC1CCCCC1)S(=O)(=O)NC.
What is the InChIKey of 1-cyclohexyl-N-methylbutane-2-sulfonamide?
The InChIKey is RUZFAOQDDMPIKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-3-11(15(13,14)12-2)9-10-7-5-4-6-8-10/h10-12H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-methylbutane-2-sulfonamide?
1-cyclohexyl-N-methylbutane-2-sulfonamide has a molecular weight of 233.38 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methylbutane-2-sulfonamide is sourced from PubChem (CID 165445824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).