N-(4-methylcyclohexyl)oxane-4-sulfonamide

C12H23NO3S — CID 177349219

IUPACN-(4-methylcyclohexyl)oxane-4-sulfonamide
SMILESCC1CCC(NS(=O)(=O)C2CCOCC2)CC1
InChIInChI=1S/C12H23NO3S/c1-10-2-4-11(5-3-10)13-17(14,15)12-6-8-16-9-7-12/h10-13H,2-9H2,1H3
InChIKeyCMIHPFWPMRVPLA-UHFFFAOYSA-N
MW261.39 g/mol
LogP1.66
Rot. Bonds3

About N-(4-methylcyclohexyl)oxane-4-sulfonamide

N-(4-methylcyclohexyl)oxane-4-sulfonamide (PubChem CID 177349219) has the molecular formula C12H23NO3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)oxane-4-sulfonamide
PubChem CID177349219
Molecular FormulaC12H23NO3S
Molecular Weight261.39 g/mol
Exact Mass261.14
IUPAC NameN-(4-methylcyclohexyl)oxane-4-sulfonamide
SMILESCC1CCC(NS(=O)(=O)C2CCOCC2)CC1
InChIInChI=1S/C12H23NO3S/c1-10-2-4-11(5-3-10)13-17(14,15)12-6-8-16-9-7-12/h10-13H,2-9H2,1H3
InChIKeyCMIHPFWPMRVPLA-UHFFFAOYSA-N
XLogP1.66
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-2-methoxyethanesulfonamide
CID 72148758
(2S)-N-(4,4-dimethylcyclohexyl)-1-methoxypropane-2-sulfonamide
CID 97575062
1-(oxan-4-yl)-N-propan-2-ylmethanesulfonamide
CID 166765445
[4-[(4-Oxo-1,4-oxathian-4-ylidene)amino]cyclohexyl]methanamine
CID 166832894
N-(5-methylhexyl)oxane-4-sulfonamide
CID 172505553
2-methoxy-N-(4-propan-2-ylcyclohexyl)ethanesulfonamide;molecular hydrogen
CID 178702034
2-methoxy-N-(4-propan-2-ylcyclohexyl)ethanesulfonamide
CID 178702035
ethane;N-(4-ethylcyclohexyl)-2-methoxyethanesulfonamide;molecular hydrogen
CID 178702139
N-(4-ethylcyclohexyl)-2-methoxyethanesulfonamide
CID 178702140
N-(4-ethylcyclohexyl)-2-methoxyethanesulfonamide;molecular hydrogen
CID 178702201
2-methoxy-N-(4-methylcyclohexyl)ethanesulfonamide
CID 178702295
ethane;N-(4-ethylcyclohexyl)-2-methoxyethanesulfonamide
CID 178762318

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)oxane-4-sulfonamide?
The IUPAC name of N-(4-methylcyclohexyl)oxane-4-sulfonamide (CID 177349219) is N-(4-methylcyclohexyl)oxane-4-sulfonamide.
What is the SMILES notation for N-(4-methylcyclohexyl)oxane-4-sulfonamide?
The canonical SMILES for N-(4-methylcyclohexyl)oxane-4-sulfonamide is CC1CCC(NS(=O)(=O)C2CCOCC2)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)oxane-4-sulfonamide?
The InChIKey is CMIHPFWPMRVPLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3S/c1-10-2-4-11(5-3-10)13-17(14,15)12-6-8-16-9-7-12/h10-13H,2-9H2,1H3.
What are the key properties of N-(4-methylcyclohexyl)oxane-4-sulfonamide?
N-(4-methylcyclohexyl)oxane-4-sulfonamide has a molecular weight of 261.39 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)oxane-4-sulfonamide is sourced from PubChem (CID 177349219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).