N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide

C14H19F2NO2S — CID 60516548

IUPACN-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide
SMILESCCN(C1CCCCC1)S(=O)(=O)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO2S/c1-2-17(12-6-4-3-5-7-12)20(18,19)14-10-11(15)8-9-13(14)16/h8-10,12H,2-7H2,1H3
InChIKeyFZBWSBXFUILYQM-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.31
Rot. Bonds4

About N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide

N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide (PubChem CID 60516548) has the molecular formula C14H19F2NO2S and a molecular weight of 303.37 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide
PubChem CID60516548
Molecular FormulaC14H19F2NO2S
Molecular Weight303.37 g/mol
Exact Mass303.11
IUPAC NameN-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide
SMILESCCN(C1CCCCC1)S(=O)(=O)c1cc(F)ccc1F
InChIInChI=1S/C14H19F2NO2S/c1-2-17(12-6-4-3-5-7-12)20(18,19)14-10-11(15)8-9-13(14)16/h8-10,12H,2-7H2,1H3
InChIKeyFZBWSBXFUILYQM-UHFFFAOYSA-N
XLogP3.31
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2,5-difluoro-N-piperidin-4-ylbenzenesulfonamide
CID 60806262
N-(2-bromoethyl)-N-cyclohexyl-2,5-difluorobenzenesulfonamide
CID 80669895
N-cyclobutyl-2,5-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102675891
N-cyclopropyl-2,5-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577623
5-chloro-N-cyclohexyl-N-ethyl-2-methoxybenzenesulfonamide
CID 897007
2,4,5-trichloro-N-cyclohexyl-N-ethylbenzenesulfonamide
CID 1178561
3-(aminomethyl)-N-cyclopentyl-N-ethyl-4-fluorobenzenesulfonamide
CID 63287839
2-chloro-N-ethyl-4-fluoro-N-piperidin-4-ylbenzenesulfonamide
CID 60806432
N-ethyl-4-fluoro-2-methyl-N-piperidin-3-ylbenzenesulfonamide
CID 60805705
2,3,4-trichloro-N-cyclohexyl-N-ethylbenzenesulfonamide
CID 50876130
4-amino-2-chloro-N-cyclohexyl-N-ethylbenzenesulfonamide
CID 43107717
2,5-difluoro-N-methyl-N-(4-methylcyclohexyl)benzenesulfonamide
CID 60545461

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide?
The IUPAC name of N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide (CID 60516548) is N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide is CCN(C1CCCCC1)S(=O)(=O)c1cc(F)ccc1F.
What is the InChIKey of N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide?
The InChIKey is FZBWSBXFUILYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO2S/c1-2-17(12-6-4-3-5-7-12)20(18,19)14-10-11(15)8-9-13(14)16/h8-10,12H,2-7H2,1H3.
What are the key properties of N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide?
N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide has a molecular weight of 303.37 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-2,5-difluorobenzenesulfonamide is sourced from PubChem (CID 60516548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).