4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride

C20H42FNO3S — CID 70217220

IUPAC4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride
SMILESCCCCCCCCCCCCC1CCC(S(=O)(=O)NCCO)CC1.F
InChIInChI=1S/C20H41NO3S.FH/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-15-20(16-14-19)25(23,24)21-17-18-22;/h19-22H,2-18H2,1H3;1H
InChIKeyDDZAAIZCRDOPHT-UHFFFAOYSA-N
MW395.63 g/mol
LogP4.92
Rot. Bonds15

About 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride

4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride (PubChem CID 70217220) has the molecular formula C20H42FNO3S and a molecular weight of 395.63 g/mol. Its IUPAC name is 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride.

Molecular Properties

Compound Name4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride
PubChem CID70217220
Molecular FormulaC20H42FNO3S
Molecular Weight395.63 g/mol
Exact Mass395.29
IUPAC Name4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride
SMILESCCCCCCCCCCCCC1CCC(S(=O)(=O)NCCO)CC1.F
InChIInChI=1S/C20H41NO3S.FH/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-15-20(16-14-19)25(23,24)21-17-18-22;/h19-22H,2-18H2,1H3;1H
InChIKeyDDZAAIZCRDOPHT-UHFFFAOYSA-N
XLogP4.92
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.63
LogP ≤ 54.92
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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Related Compounds

4-dodecyl-1,2,2,3,3,4,5,5,6,6-decafluoro-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide
CID 88448992
N-(2-hydroxyethyl)-5-methyl-2-propan-2-ylcyclohexane-1-sulfonamide
CID 21439263
N-(2-hydroxyethyl)-2-methylcyclohexane-1-sulfonamide;hydrofluoride
CID 70218510
N-(3-hydroxypropyl)-4-propan-2-ylcyclohexane-1-sulfonamide
CID 170667026
1-cyclohexyl-N-(2-hydroxyethyl)methanesulfonamide
CID 61453744
1-cyclohexyl-N-(1-hydroxypropan-2-yl)methanesulfonamide
CID 61453745
1-cyclohexyl-N-(2-hydroxypropyl)methanesulfonamide
CID 61453746
1-cyclohexyl-N-[(2R)-1-hydroxypropan-2-yl]methanesulfonamide
CID 64722343
4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide
CID 70217221
N-(2-hydroxyethyl)-2-methylcyclohexane-1-sulfonamide
CID 70218511
1-cyclohexyl-N-[(2S)-1-hydroxypropan-2-yl]methanesulfonamide
CID 79023687
N-[(4-ethylcyclohexyl)methyl]-2-hydroxyethanesulfonamide
CID 79578687

Frequently Asked Questions

What is the IUPAC name of 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride?
The IUPAC name of 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride (CID 70217220) is 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride.
What is the SMILES notation for 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride?
The canonical SMILES for 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride is CCCCCCCCCCCCC1CCC(S(=O)(=O)NCCO)CC1.F.
What is the InChIKey of 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride?
The InChIKey is DDZAAIZCRDOPHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO3S.FH/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-15-20(16-14-19)25(23,24)21-17-18-22;/h19-22H,2-18H2,1H3;1H.
What are the key properties of 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride?
4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride has a molecular weight of 395.63 g/mol, XLogP of 4.92, 15 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dodecyl-N-(2-hydroxyethyl)cyclohexane-1-sulfonamide;hydrofluoride is sourced from PubChem (CID 70217220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).