N-(cyclohexylmethyl)ethanesulfonamide

C9H19NO2S — CID 6466313

IUPACN-(cyclohexylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C9H19NO2S/c1-2-13(11,12)10-8-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3
InChIKeySPBRFGFWNUWMNK-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.51
Rot. Bonds4

About N-(cyclohexylmethyl)ethanesulfonamide

N-(cyclohexylmethyl)ethanesulfonamide (PubChem CID 6466313) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is N-(cyclohexylmethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)ethanesulfonamide
PubChem CID6466313
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC NameN-(cyclohexylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C9H19NO2S/c1-2-13(11,12)10-8-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3
InChIKeySPBRFGFWNUWMNK-UHFFFAOYSA-N
XLogP1.51
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclohexylmethyl)-3-(ethylamino)propane-1-sulfonamide
CID 106027864
N-(cyclohexylmethyl)-4-(propylamino)butane-1-sulfonamide
CID 106028001
N-(cyclobutylmethyl)-2-(propylamino)ethanesulfonamide
CID 103096884
N-(cyclohexylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 54972626
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]ethanesulfonamide
CID 61355216
1-[4-(aminomethyl)phenyl]-N-(cyclohexylmethyl)methanesulfonamide
CID 43371562
N-(cyclohexylmethyl)-2-piperidin-2-ylethanesulfonamide
CID 60863668
N-(cyclohexylmethyl)-4-ethylbenzenesulfonamide
CID 3776153
N-(cycloheptylmethyl)-4-methylbenzenesulfonamide
CID 134942537
N-[(3-hydroxycyclohexyl)methyl]propane-1-sulfonamide
CID 103697688
N-[(3-chlorocyclohexyl)methyl]-1-cyclohexylmethanesulfonamide
CID 114148320
3-(cyclobutylmethylsulfamoyl)propanoic acid
CID 43298604

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)ethanesulfonamide?
The IUPAC name of N-(cyclohexylmethyl)ethanesulfonamide (CID 6466313) is N-(cyclohexylmethyl)ethanesulfonamide.
What is the SMILES notation for N-(cyclohexylmethyl)ethanesulfonamide?
The canonical SMILES for N-(cyclohexylmethyl)ethanesulfonamide is CCS(=O)(=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)ethanesulfonamide?
The InChIKey is SPBRFGFWNUWMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-2-13(11,12)10-8-9-6-4-3-5-7-9/h9-10H,2-8H2,1H3.
What are the key properties of N-(cyclohexylmethyl)ethanesulfonamide?
N-(cyclohexylmethyl)ethanesulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)ethanesulfonamide is sourced from PubChem (CID 6466313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).