N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide

C15H23NO3S — CID 2234313

IUPACN-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NC2CCCCC2)c(C)c1C
InChIInChI=1S/C15H23NO3S/c1-11-12(2)15(10-9-14(11)19-3)20(17,18)16-13-7-5-4-6-8-13/h9-10,13,16H,4-8H2,1-3H3
InChIKeyZMHDADCLQSKBRJ-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.92
Rot. Bonds4

About N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide

N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide (PubChem CID 2234313) has the molecular formula C15H23NO3S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide
PubChem CID2234313
Molecular FormulaC15H23NO3S
Molecular Weight297.42 g/mol
Exact Mass297.14
IUPAC NameN-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NC2CCCCC2)c(C)c1C
InChIInChI=1S/C15H23NO3S/c1-11-12(2)15(10-9-14(11)19-3)20(17,18)16-13-7-5-4-6-8-13/h9-10,13,16H,4-8H2,1-3H3
InChIKeyZMHDADCLQSKBRJ-UHFFFAOYSA-N
XLogP2.92
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2,4-dimethoxy-3-methylbenzenesulfonamide
CID 110758716
N-cyclopentyl-4-methoxynaphthalene-1-sulfonamide
CID 7314514
N-cyclopentyl-2-methoxy-4-methylbenzenesulfonamide
CID 172906018
N-cyclohexyl-2,5-dimethoxy-4-methylbenzenesulfonamide
CID 6464098
N-cyclohexyl-4-methoxy-2,5-dimethylbenzenesulfonamide
CID 47314932
N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-4-methoxy-2,3-dimethylbenzenesulfonamide
CID 125057999
5-(aminomethyl)-N-cyclohexyl-2-methoxybenzenesulfonamide
CID 28717716
N-cyclopentyl-2-methoxy-4-propan-2-ylbenzenesulfonamide
CID 110758409
4-(cyclopentylsulfamoyl)-3-methoxybenzoic acid
CID 102694641
4-chloro-N-cycloheptyl-2,5-dimethoxybenzenesulfonamide
CID 2200633
4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide
CID 100753581
N-cyclohexyl-3-(methanesulfonamido)-2,4-dimethylbenzenesulfonamide
CID 2973665

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide?
The IUPAC name of N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide (CID 2234313) is N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide?
The canonical SMILES for N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide is COc1ccc(S(=O)(=O)NC2CCCCC2)c(C)c1C.
What is the InChIKey of N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide?
The InChIKey is ZMHDADCLQSKBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3S/c1-11-12(2)15(10-9-14(11)19-3)20(17,18)16-13-7-5-4-6-8-13/h9-10,13,16H,4-8H2,1-3H3.
What are the key properties of N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide?
N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide is sourced from PubChem (CID 2234313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).