N-(4-tert-butylcyclohexyl)methanesulfonamide

C11H23NO2S — CID 22772448

IUPACN-(4-tert-butylcyclohexyl)methanesulfonamide
SMILESCC(C)(C)C1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C11H23NO2S/c1-11(2,3)9-5-7-10(8-6-9)12-15(4,13)14/h9-10,12H,5-8H2,1-4H3
InChIKeyOXWISRWQTBZYPA-UHFFFAOYSA-N
MW233.38 g/mol
LogP2.14
Rot. Bonds2

About N-(4-tert-butylcyclohexyl)methanesulfonamide

N-(4-tert-butylcyclohexyl)methanesulfonamide (PubChem CID 22772448) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-(4-tert-butylcyclohexyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-tert-butylcyclohexyl)methanesulfonamide
PubChem CID22772448
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-(4-tert-butylcyclohexyl)methanesulfonamide
SMILESCC(C)(C)C1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C11H23NO2S/c1-11(2,3)9-5-7-10(8-6-9)12-15(4,13)14/h9-10,12H,5-8H2,1-4H3
InChIKeyOXWISRWQTBZYPA-UHFFFAOYSA-N
XLogP2.14
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylcyclohexyl)methanesulfonamide?
The IUPAC name of N-(4-tert-butylcyclohexyl)methanesulfonamide (CID 22772448) is N-(4-tert-butylcyclohexyl)methanesulfonamide.
What is the SMILES notation for N-(4-tert-butylcyclohexyl)methanesulfonamide?
The canonical SMILES for N-(4-tert-butylcyclohexyl)methanesulfonamide is CC(C)(C)C1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-(4-tert-butylcyclohexyl)methanesulfonamide?
The InChIKey is OXWISRWQTBZYPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-11(2,3)9-5-7-10(8-6-9)12-15(4,13)14/h9-10,12H,5-8H2,1-4H3.
What are the key properties of N-(4-tert-butylcyclohexyl)methanesulfonamide?
N-(4-tert-butylcyclohexyl)methanesulfonamide has a molecular weight of 233.38 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylcyclohexyl)methanesulfonamide is sourced from PubChem (CID 22772448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).