N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide

C14H20FNO2S — CID 892144

IUPACN-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide
SMILESCc1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1F
InChIInChI=1S/C14H20FNO2S/c1-11-10-13(8-9-14(11)15)19(17,18)16(2)12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyRMXOXURBXNTQOW-UHFFFAOYSA-N
MW285.38 g/mol
LogP3.09
Rot. Bonds3

About N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide

N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide (PubChem CID 892144) has the molecular formula C14H20FNO2S and a molecular weight of 285.38 g/mol. Its IUPAC name is N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide
PubChem CID892144
Molecular FormulaC14H20FNO2S
Molecular Weight285.38 g/mol
Exact Mass285.12
IUPAC NameN-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide
SMILESCc1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1F
InChIInChI=1S/C14H20FNO2S/c1-11-10-13(8-9-14(11)15)19(17,18)16(2)12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyRMXOXURBXNTQOW-UHFFFAOYSA-N
XLogP3.09
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-cyclohexyl-N,3-dimethylbenzenesulfonamide
CID 42997513
N-cyclohexyl-3-fluoro-N-methylbenzenesulfonamide
CID 78786922
4-[cyclohexyl(methyl)sulfamoyl]-2-methylbenzenecarbothioamide
CID 106919946
N-cycloheptyl-3,5-difluoro-N-methylbenzenesulfonamide
CID 55476609
N-cycloheptyl-4-fluoro-N,2,6-trimethylbenzenesulfonamide
CID 107326759
N-cyclohexyl-N-methyl-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 2142659
3,4-difluoro-N-methyl-N-(4-oxocyclohexyl)benzenesulfonamide
CID 79119655
3-amino-N-cyclohexyl-4-ethyl-N-methylbenzenesulfonamide
CID 43257349
1-(4-fluoro-3-methylphenyl)sulfonyl-N,N-dimethylpiperidin-4-amine
CID 110868573
3-amino-N-cyclohexyl-4-fluoro-N,2,6-trimethylbenzenesulfonamide
CID 107325531
4-bromo-N-cyclopentyl-N-methylbenzenesulfonamide
CID 28632510
N-(3,4-dihydro-2H-chromen-4-yl)-4-fluoro-N,3-dimethylbenzenesulfonamide
CID 110751222

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide?
The IUPAC name of N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide (CID 892144) is N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide?
The canonical SMILES for N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide is Cc1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1F.
What is the InChIKey of N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide?
The InChIKey is RMXOXURBXNTQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2S/c1-11-10-13(8-9-14(11)15)19(17,18)16(2)12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3.
What are the key properties of N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide?
N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide has a molecular weight of 285.38 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-fluoro-N,3-dimethylbenzenesulfonamide is sourced from PubChem (CID 892144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).