N-cyclooctyl-3-fluorobenzenesulfonamide

C14H20FNO2S — CID 26948335

IUPACN-cyclooctyl-3-fluorobenzenesulfonamide
SMILESO=S(=O)(NC1CCCCCCC1)c1cccc(F)c1
InChIInChI=1S/C14H20FNO2S/c15-12-7-6-10-14(11-12)19(17,18)16-13-8-4-2-1-3-5-9-13/h6-7,10-11,13,16H,1-5,8-9H2
InChIKeyGGMXEVMKTQXOMS-UHFFFAOYSA-N
MW285.38 g/mol
LogP3.22
Rot. Bonds3

About N-cyclooctyl-3-fluorobenzenesulfonamide

N-cyclooctyl-3-fluorobenzenesulfonamide (PubChem CID 26948335) has the molecular formula C14H20FNO2S and a molecular weight of 285.38 g/mol. Its IUPAC name is N-cyclooctyl-3-fluorobenzenesulfonamide.

Molecular Properties

Compound NameN-cyclooctyl-3-fluorobenzenesulfonamide
PubChem CID26948335
Molecular FormulaC14H20FNO2S
Molecular Weight285.38 g/mol
Exact Mass285.12
IUPAC NameN-cyclooctyl-3-fluorobenzenesulfonamide
SMILESO=S(=O)(NC1CCCCCCC1)c1cccc(F)c1
InChIInChI=1S/C14H20FNO2S/c15-12-7-6-10-14(11-12)19(17,18)16-13-8-4-2-1-3-5-9-13/h6-7,10-11,13,16H,1-5,8-9H2
InChIKeyGGMXEVMKTQXOMS-UHFFFAOYSA-N
XLogP3.22
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromocyclohexyl)-3-fluorobenzenesulfonamide
CID 113271378
N-(4-aminocyclohexyl)-3-fluorobenzenesulfonamide;hydrochloride
CID 119970669
N-(2-chlorocycloheptyl)-3-fluorobenzenesulfonamide
CID 113395199
N-cyclooctyl-3-methylbenzenesulfonamide
CID 2497018
N-cyclohexyl-3-methylsulfonylbenzenesulfonamide
CID 6462647
N-cyclopentyl-3-[4-(3-fluorobenzoyl)piperazine-1-carbonyl]benzenesulfonamide
CID 30855365
3-fluoro-N-[(3R)-pyrrolidin-3-yl]benzenesulfonamide
CID 79685503
N-cyclohexyl-3,4-difluorobenzenesulfonamide
CID 19681091
3-fluoro-N-(1-methylsulfonylpiperidin-3-yl)benzenesulfonamide
CID 47958214
3-fluoro-N-(1-pyrimidin-2-ylpiperidin-3-yl)benzenesulfonamide
CID 133269920
3-(1-aminoethyl)-N-cyclopentylbenzenesulfonamide
CID 43101815
N-cycloheptyl-3-nitrobenzenesulfonamide
CID 19203727

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-3-fluorobenzenesulfonamide?
The IUPAC name of N-cyclooctyl-3-fluorobenzenesulfonamide (CID 26948335) is N-cyclooctyl-3-fluorobenzenesulfonamide.
What is the SMILES notation for N-cyclooctyl-3-fluorobenzenesulfonamide?
The canonical SMILES for N-cyclooctyl-3-fluorobenzenesulfonamide is O=S(=O)(NC1CCCCCCC1)c1cccc(F)c1.
What is the InChIKey of N-cyclooctyl-3-fluorobenzenesulfonamide?
The InChIKey is GGMXEVMKTQXOMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2S/c15-12-7-6-10-14(11-12)19(17,18)16-13-8-4-2-1-3-5-9-13/h6-7,10-11,13,16H,1-5,8-9H2.
What are the key properties of N-cyclooctyl-3-fluorobenzenesulfonamide?
N-cyclooctyl-3-fluorobenzenesulfonamide has a molecular weight of 285.38 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-3-fluorobenzenesulfonamide is sourced from PubChem (CID 26948335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).