2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide

C15H24N2O5S — CID 120876553

IUPAC2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide
SMILESCOc1cc(OC)c(S(=O)(=O)NC2CCNCC2C)c(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-10-9-16-6-5-12(10)17-23(18,19)15-13(21-3)7-11(20-2)8-14(15)22-4/h7-8,10,12,16-17H,5-6,9H2,1-4H3
InChIKeyDPDYSSPFVCNMEL-UHFFFAOYSA-N
MW344.43 g/mol
LogP0.99
Rot. Bonds6

About 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide

2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide (PubChem CID 120876553) has the molecular formula C15H24N2O5S and a molecular weight of 344.43 g/mol. Its IUPAC name is 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide.

Molecular Properties

Compound Name2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide
PubChem CID120876553
Molecular FormulaC15H24N2O5S
Molecular Weight344.43 g/mol
Exact Mass344.14
IUPAC Name2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide
SMILESCOc1cc(OC)c(S(=O)(=O)NC2CCNCC2C)c(OC)c1
InChIInChI=1S/C15H24N2O5S/c1-10-9-16-6-5-12(10)17-23(18,19)15-13(21-3)7-11(20-2)8-14(15)22-4/h7-8,10,12,16-17H,5-6,9H2,1-4H3
InChIKeyDPDYSSPFVCNMEL-UHFFFAOYSA-N
XLogP0.99
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide 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

2-bromo-4-methoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120725133
2,5-dichloro-4-methoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzenesulfonamide
CID 129467888
4-bromo-3-methoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120724741
4-methoxy-3-methyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120725010
2,5-dichloro-4-methoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120724939
3-methoxy-N-(3-methylpiperidin-4-yl)thiophene-2-sulfonamide
CID 120725164
4-methoxy-3,5-dimethyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120725107
4-methoxy-N-(3-methylpiperidin-4-yl)naphthalene-1-sulfonamide
CID 120725200
4-(ethylsulfonylamino)-2-methoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120724693
2,4-dimethoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzamide
CID 124516888
3,5-dimethyl-N-[(3S,4S)-3-methylpiperidin-4-yl]-1H-pyrazole-4-sulfonamide
CID 124516985
N-cyclopropyl-2,4,6-trimethoxy-N-pyrrolidin-3-ylbenzenesulfonamide
CID 120875651

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide?
The IUPAC name of 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide (CID 120876553) is 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide.
What is the SMILES notation for 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide?
The canonical SMILES for 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide is COc1cc(OC)c(S(=O)(=O)NC2CCNCC2C)c(OC)c1.
What is the InChIKey of 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide?
The InChIKey is DPDYSSPFVCNMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O5S/c1-10-9-16-6-5-12(10)17-23(18,19)15-13(21-3)7-11(20-2)8-14(15)22-4/h7-8,10,12,16-17H,5-6,9H2,1-4H3.
What are the key properties of 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide?
2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide has a molecular weight of 344.43 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethoxy-N-(3-methylpiperidin-4-yl)benzenesulfonamide is sourced from PubChem (CID 120876553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).