N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide

C15H23FN2O2S — CID 43653558

IUPACN-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide
SMILESCCNC1CCC(NS(=O)(=O)c2cc(F)ccc2C)CC1
InChIInChI=1S/C15H23FN2O2S/c1-3-17-13-6-8-14(9-7-13)18-21(19,20)15-10-12(16)5-4-11(15)2/h4-5,10,13-14,17-18H,3,6-9H2,1-2H3
InChIKeySVJMIWAQKAUVPH-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.33
Rot. Bonds5

About N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide

N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide (PubChem CID 43653558) has the molecular formula C15H23FN2O2S and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide
PubChem CID43653558
Molecular FormulaC15H23FN2O2S
Molecular Weight314.43 g/mol
Exact Mass314.15
IUPAC NameN-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide
SMILESCCNC1CCC(NS(=O)(=O)c2cc(F)ccc2C)CC1
InChIInChI=1S/C15H23FN2O2S/c1-3-17-13-6-8-14(9-7-13)18-21(19,20)15-10-12(16)5-4-11(15)2/h4-5,10,13-14,17-18H,3,6-9H2,1-2H3
InChIKeySVJMIWAQKAUVPH-UHFFFAOYSA-N
XLogP2.33
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(ethylamino)cyclohexyl]-2,5-difluorobenzenesulfonamide
CID 43653555
4-(2,4-difluorophenyl)-N-[4-(ethylamino)cyclohexyl]benzenesulfonamide
CID 45279055
4-fluoro-N-[4-(propylamino)cyclohexyl]benzenesulfonamide
CID 43653616
N-cyclohexyl-2-(ethylaminomethyl)-5-fluorobenzenesulfonamide
CID 102920439
N-[2-(chloromethyl)cyclopentyl]-5-fluoro-2-methylbenzenesulfonamide
CID 106367588
4-fluoro-2-methyl-N-piperidin-4-ylbenzenesulfonamide
CID 28810997
N-(2-adamantyl)-5-fluoro-2-methylbenzenesulfonamide
CID 112823935
N-(2-bromo-2-cyclopropylethyl)-5-fluoro-2-methylbenzenesulfonamide
CID 113271162
5-fluoro-2-methyl-N-[(1R,2S)-2-(trifluoromethyl)cyclohexyl]benzenesulfonamide
CID 39630411
5-fluoro-2-methyl-N-[(1R,2R)-2-(trifluoromethyl)cyclohexyl]benzenesulfonamide
CID 39630415
5-fluoro-N-(5-fluoro-2-methylphenyl)-2-methylbenzenesulfonamide
CID 47309539
5-bromo-2-methyl-N-(4-methylcyclohexyl)benzenesulfonamide
CID 60660580

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide?
The IUPAC name of N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide (CID 43653558) is N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide.
What is the SMILES notation for N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide?
The canonical SMILES for N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide is CCNC1CCC(NS(=O)(=O)c2cc(F)ccc2C)CC1.
What is the InChIKey of N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide?
The InChIKey is SVJMIWAQKAUVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O2S/c1-3-17-13-6-8-14(9-7-13)18-21(19,20)15-10-12(16)5-4-11(15)2/h4-5,10,13-14,17-18H,3,6-9H2,1-2H3.
What are the key properties of N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide?
N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide has a molecular weight of 314.43 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylamino)cyclohexyl]-5-fluoro-2-methylbenzenesulfonamide is sourced from PubChem (CID 43653558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).