N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide

C14H21NO3S — CID 801220

IUPACN-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H21NO3S/c1-11-8-9-13(18-2)14(10-11)19(16,17)15-12-6-4-3-5-7-12/h8-10,12,15H,3-7H2,1-2H3
InChIKeyFUAFLQVCCACKDD-UHFFFAOYSA-N
MW283.39 g/mol
LogP2.61
Rot. Bonds4

About N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide

N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide (PubChem CID 801220) has the molecular formula C14H21NO3S and a molecular weight of 283.39 g/mol. Its IUPAC name is N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide
PubChem CID801220
Molecular FormulaC14H21NO3S
Molecular Weight283.39 g/mol
Exact Mass283.12
IUPAC NameN-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H21NO3S/c1-11-8-9-13(18-2)14(10-11)19(16,17)15-12-6-4-3-5-7-12/h8-10,12,15H,3-7H2,1-2H3
InChIKeyFUAFLQVCCACKDD-UHFFFAOYSA-N
XLogP2.61
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxybenzyl)benzenesulfonamide
CID 854251
N-cyclopentyl-4-ethoxy-3-methylbenzenesulfonamide
CID 2992053
5-isopropyl-2-methoxy-N-(tetrahydro-2-furanylmethyl)benzenesulfonamide
CID 4565916
4-methoxy-N-(4-phenylbutan-2-yl)benzenesulfonamide
CID 2915782
4-methoxy-N-(4-methoxybenzyl)benzenesulfonamide
CID 741350
N-benzyl-2,5-dimethoxybenzenesulfonamide
CID 741450
4-methoxy-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 868666
Benzene-1,4-disulfonic acid 1-cyclopropylamide 4-(4-methoxy-benzylamide)
CID 1429251
4-Methoxy-N-(3-phenylpropyl)benzenesulfonamide
CID 1718316
4-fluoro-3-methoxy-N-(2-methylcyclohexyl)benzenesulfonamide
CID 2989021
4-Methoxy-N-phenethyl-benzenesulfonamide
CID 739803
N-benzyl-4-methoxybenzenesulfonamide
CID 741351

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide?
The IUPAC name of N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide (CID 801220) is N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide?
The canonical SMILES for N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide is COc1ccc(C)cc1S(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide?
The InChIKey is FUAFLQVCCACKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3S/c1-11-8-9-13(18-2)14(10-11)19(16,17)15-12-6-4-3-5-7-12/h8-10,12,15H,3-7H2,1-2H3.
What are the key properties of N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide?
N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide has a molecular weight of 283.39 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methoxy-5-methylbenzenesulfonamide is sourced from PubChem (CID 801220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).