N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide

C13H26N2O3S — CID 62048243

IUPACN-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide
SMILESNCC(NS(=O)(=O)C1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H26N2O3S/c14-10-13(11-4-2-1-3-5-11)15-19(16,17)12-6-8-18-9-7-12/h11-13,15H,1-10,14H2
InChIKeyDKEOBACBIASYCL-UHFFFAOYSA-N
MW290.43 g/mol
LogP0.99
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide

N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide (PubChem CID 62048243) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide
PubChem CID62048243
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide
SMILESNCC(NS(=O)(=O)C1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H26N2O3S/c14-10-13(11-4-2-1-3-5-11)15-19(16,17)12-6-8-18-9-7-12/h11-13,15H,1-10,14H2
InChIKeyDKEOBACBIASYCL-UHFFFAOYSA-N
XLogP0.99
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylcyclohexyl)oxane-4-sulfonamide
CID 177349219
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
ethane;N-(4-ethylcyclohexyl)-2-methoxyethanesulfonamide
CID 178762318
N-(2-amino-1-cyclohexylethyl)-2-methoxyethanesulfonamide
CID 55009587
2-Cyclohexyl-2-(2-methoxyethylsulfonylamino)ethanethioamide
CID 55014070
N-[1-(aminomethyl)cycloheptyl]oxane-4-sulfonamide
CID 55031293
N-(2-amino-1-cyclohexylethyl)-1-(oxolan-2-yl)methanesulfonamide
CID 55174883
N-[(1-aminocycloheptyl)methyl]oxane-4-sulfonamide
CID 62047541
N-(2-aminocyclohexyl)oxane-4-sulfonamide
CID 62047552
2-Cyclohexyl-2-(oxan-4-ylsulfonylamino)ethanethioamide
CID 62047722

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide (CID 62048243) is N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide is NCC(NS(=O)(=O)C1CCOCC1)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide?
The InChIKey is DKEOBACBIASYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c14-10-13(11-4-2-1-3-5-11)15-19(16,17)12-6-8-18-9-7-12/h11-13,15H,1-10,14H2.
What are the key properties of N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide?
N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)oxane-4-sulfonamide is sourced from PubChem (CID 62048243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).