N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide

C16H18FNO2S — CID 589300

IUPACN-cyclohexyl-4-fluoronaphthalene-1-sulfonamide
SMILESO=S(=O)(NC1CCCCC1)c1ccc(F)c2ccccc12
InChIInChI=1S/C16H18FNO2S/c17-15-10-11-16(14-9-5-4-8-13(14)15)21(19,20)18-12-6-2-1-3-7-12/h4-5,8-12,18H,1-3,6-7H2
InChIKeyXSCFBUZHNYWVJO-UHFFFAOYSA-N
MW307.39 g/mol
LogP3.59
Rot. Bonds3

About N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide

N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide (PubChem CID 589300) has the molecular formula C16H18FNO2S and a molecular weight of 307.39 g/mol. Its IUPAC name is N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-4-fluoronaphthalene-1-sulfonamide
PubChem CID589300
Molecular FormulaC16H18FNO2S
Molecular Weight307.39 g/mol
Exact Mass307.10
IUPAC NameN-cyclohexyl-4-fluoronaphthalene-1-sulfonamide
SMILESO=S(=O)(NC1CCCCC1)c1ccc(F)c2ccccc12
InChIInChI=1S/C16H18FNO2S/c17-15-10-11-16(14-9-5-4-8-13(14)15)21(19,20)18-12-6-2-1-3-7-12/h4-5,8-12,18H,1-3,6-7H2
InChIKeyXSCFBUZHNYWVJO-UHFFFAOYSA-N
XLogP3.59
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-cyclopentylnaphthalene-1-sulfonamide
CID 91800387
N-cyclohexylnaphthalene-1-sulfonamide
CID 3812052
N-cyclopentyl-4-methoxynaphthalene-1-sulfonamide
CID 7314514
5-chloro-N-cyclopentyl-2-fluorobenzenesulfonamide
CID 110759330
4-bromo-N-cyclooctyl-2-fluorobenzenesulfonamide
CID 116528049
N-cyclobutyl-4-ethoxynaphthalene-1-sulfonamide
CID 172880543
2-amino-N-cycloheptylbenzenesulfonamide
CID 28590104
N-cyclohexyl-3,4-difluorobenzenesulfonamide
CID 19681091
N-cyclohexyl-2-[[2-(cyclohexylsulfamoyl)phenyl]diselanyl]benzenesulfonamide
CID 10908359
N-[5-(cyclohexylsulfamoyl)naphthalen-1-yl]benzamide
CID 59718017
4-(cyclohexylsulfamoyl)-3-fluorobenzoic acid
CID 79187274
2-(cycloheptylamino)-N-cyclopropylbenzenesulfonamide
CID 43454674

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide?
The IUPAC name of N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide (CID 589300) is N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide.
What is the SMILES notation for N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide?
The canonical SMILES for N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide is O=S(=O)(NC1CCCCC1)c1ccc(F)c2ccccc12.
What is the InChIKey of N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide?
The InChIKey is XSCFBUZHNYWVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO2S/c17-15-10-11-16(14-9-5-4-8-13(14)15)21(19,20)18-12-6-2-1-3-7-12/h4-5,8-12,18H,1-3,6-7H2.
What are the key properties of N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide?
N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide has a molecular weight of 307.39 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-fluoronaphthalene-1-sulfonamide is sourced from PubChem (CID 589300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).