N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide

C10H23NO3S — CID 64591573

IUPACN-hexyl-N-(2-hydroxyethyl)ethanesulfonamide
SMILESCCCCCCN(CCO)S(=O)(=O)CC
InChIInChI=1S/C10H23NO3S/c1-3-5-6-7-8-11(9-10-12)15(13,14)4-2/h12H,3-10H2,1-2H3
InChIKeyHYGWVXXGZGNGDC-UHFFFAOYSA-N
MW237.36 g/mol
LogP1.21
Rot. Bonds9

About N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide

N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide (PubChem CID 64591573) has the molecular formula C10H23NO3S and a molecular weight of 237.36 g/mol. Its IUPAC name is N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-hexyl-N-(2-hydroxyethyl)ethanesulfonamide
PubChem CID64591573
Molecular FormulaC10H23NO3S
Molecular Weight237.36 g/mol
Exact Mass237.14
IUPAC NameN-hexyl-N-(2-hydroxyethyl)ethanesulfonamide
SMILESCCCCCCN(CCO)S(=O)(=O)CC
InChIInChI=1S/C10H23NO3S/c1-3-5-6-7-8-11(9-10-12)15(13,14)4-2/h12H,3-10H2,1-2H3
InChIKeyHYGWVXXGZGNGDC-UHFFFAOYSA-N
XLogP1.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide?
The IUPAC name of N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide (CID 64591573) is N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide.
What is the SMILES notation for N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide?
The canonical SMILES for N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide is CCCCCCN(CCO)S(=O)(=O)CC.
What is the InChIKey of N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide?
The InChIKey is HYGWVXXGZGNGDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO3S/c1-3-5-6-7-8-11(9-10-12)15(13,14)4-2/h12H,3-10H2,1-2H3.
What are the key properties of N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide?
N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide has a molecular weight of 237.36 g/mol, XLogP of 1.21, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-N-(2-hydroxyethyl)ethanesulfonamide is sourced from PubChem (CID 64591573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).