6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide

C14H30N2O2S — CID 70654491

IUPAC6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide
SMILESNCCCCCCS(=O)(=O)NCCC1CCCCC1
InChIInChI=1S/C14H30N2O2S/c15-11-6-1-2-7-13-19(17,18)16-12-10-14-8-4-3-5-9-14/h14,16H,1-13,15H2
InChIKeyNSRPKJQRIFVQEY-UHFFFAOYSA-N
MW290.47 g/mol
LogP2.40
Rot. Bonds10

About 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide

6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide (PubChem CID 70654491) has the molecular formula C14H30N2O2S and a molecular weight of 290.47 g/mol. Its IUPAC name is 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide
PubChem CID70654491
Molecular FormulaC14H30N2O2S
Molecular Weight290.47 g/mol
Exact Mass290.20
IUPAC Name6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide
SMILESNCCCCCCS(=O)(=O)NCCC1CCCCC1
InChIInChI=1S/C14H30N2O2S/c15-11-6-1-2-7-13-19(17,18)16-12-10-14-8-4-3-5-9-14/h14,16H,1-13,15H2
InChIKeyNSRPKJQRIFVQEY-UHFFFAOYSA-N
XLogP2.40
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.47
LogP ≤ 52.40
H-Bond Donors ≤ 52
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 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide?
The IUPAC name of 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide (CID 70654491) is 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide.
What is the SMILES notation for 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide?
The canonical SMILES for 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide is NCCCCCCS(=O)(=O)NCCC1CCCCC1.
What is the InChIKey of 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide?
The InChIKey is NSRPKJQRIFVQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2S/c15-11-6-1-2-7-13-19(17,18)16-12-10-14-8-4-3-5-9-14/h14,16H,1-13,15H2.
What are the key properties of 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide?
6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide has a molecular weight of 290.47 g/mol, XLogP of 2.40, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-cyclohexylethyl)hexane-1-sulfonamide is sourced from PubChem (CID 70654491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).