2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride

C15H25ClN2O3S — CID 120726218

IUPAC2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
SMILESCOc1cc(C)cc(C)c1S(=O)(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C15H24N2O3S.ClH/c1-10-8-11(2)15(14(9-10)20-4)21(18,19)17-13-6-5-7-16-12(13)3;/h8-9,12-13,16-17H,5-7H2,1-4H3;1H
InChIKeySAFAKBALEQWYFC-UHFFFAOYSA-N
MW348.90 g/mol
LogP2.15
Rot. Bonds4

About 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride

2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride (PubChem CID 120726218) has the molecular formula C15H25ClN2O3S and a molecular weight of 348.90 g/mol. Its IUPAC name is 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride.

Molecular Properties

Compound Name2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
PubChem CID120726218
Molecular FormulaC15H25ClN2O3S
Molecular Weight348.90 g/mol
Exact Mass348.13
IUPAC Name2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
SMILESCOc1cc(C)cc(C)c1S(=O)(=O)NC1CCCNC1C.Cl
InChIInChI=1S/C15H24N2O3S.ClH/c1-10-8-11(2)15(14(9-10)20-4)21(18,19)17-13-6-5-7-16-12(13)3;/h8-9,12-13,16-17H,5-7H2,1-4H3;1H
InChIKeySAFAKBALEQWYFC-UHFFFAOYSA-N
XLogP2.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.90
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride 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

3,5-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide
CID 114695181
N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide
CID 110759510
2,4-dimethyl-N-[(2R,3R)-2-methylpiperidin-3-yl]benzenesulfonamide
CID 124515702
3-methoxy-N-(2-methylpiperidin-3-yl)thiophene-2-sulfonamide;hydrochloride
CID 120726757
3,4-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide
CID 79044055
4-methyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
CID 120726682
2,6-difluoro-N-(2-methylpiperidin-3-yl)benzenesulfonamide
CID 114695279
methyl 5-methyl-2-[(2-methylpiperidin-3-yl)sulfamoyl]benzoate;hydrochloride
CID 120726210
5-bromo-2-methyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
CID 120726195
4-methyl-N-(2-methylpiperidin-3-yl)-3-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120726129
3-methyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide
CID 79043800
dimethyl 2-[(2-methylpiperidin-3-yl)sulfamoyl]benzene-1,4-dicarboxylate;hydrochloride
CID 120726589

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride?
The IUPAC name of 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride (CID 120726218) is 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride.
What is the SMILES notation for 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride?
The canonical SMILES for 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride is COc1cc(C)cc(C)c1S(=O)(=O)NC1CCCNC1C.Cl.
What is the InChIKey of 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride?
The InChIKey is SAFAKBALEQWYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S.ClH/c1-10-8-11(2)15(14(9-10)20-4)21(18,19)17-13-6-5-7-16-12(13)3;/h8-9,12-13,16-17H,5-7H2,1-4H3;1H.
What are the key properties of 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride?
2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride has a molecular weight of 348.90 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride is sourced from PubChem (CID 120726218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).