N-(4-aminocyclohexyl)ethanesulfonamide

C8H18N2O2S — CID 10444438

IUPACN-(4-aminocyclohexyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8-5-3-7(9)4-6-8/h7-8,10H,2-6,9H2,1H3
InChIKeyFPGMIEHZKLHZTF-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.20
Rot. Bonds3

About N-(4-aminocyclohexyl)ethanesulfonamide

N-(4-aminocyclohexyl)ethanesulfonamide (PubChem CID 10444438) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)ethanesulfonamide
PubChem CID10444438
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-(4-aminocyclohexyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8-5-3-7(9)4-6-8/h7-8,10H,2-6,9H2,1H3
InChIKeyFPGMIEHZKLHZTF-UHFFFAOYSA-N
XLogP0.20
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)ethanesulfonamide?
The IUPAC name of N-(4-aminocyclohexyl)ethanesulfonamide (CID 10444438) is N-(4-aminocyclohexyl)ethanesulfonamide.
What is the SMILES notation for N-(4-aminocyclohexyl)ethanesulfonamide?
The canonical SMILES for N-(4-aminocyclohexyl)ethanesulfonamide is CCS(=O)(=O)NC1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)ethanesulfonamide?
The InChIKey is FPGMIEHZKLHZTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-2-13(11,12)10-8-5-3-7(9)4-6-8/h7-8,10H,2-6,9H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)ethanesulfonamide?
N-(4-aminocyclohexyl)ethanesulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)ethanesulfonamide is sourced from PubChem (CID 10444438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).