N-(3,4,5-trimethoxyphenyl)methanesulfonamide

C10H15NO5S — CID 2991852

IUPACN-(3,4,5-trimethoxyphenyl)methanesulfonamide
SMILESCOc1cc(NS(C)(=O)=O)cc(OC)c1OC
InChIInChI=1S/C10H15NO5S/c1-14-8-5-7(11-17(4,12)13)6-9(15-2)10(8)16-3/h5-6,11H,1-4H3
InChIKeyGNVPPYRMRUWSPJ-UHFFFAOYSA-N
MW261.30 g/mol
LogP1.08
Rot. Bonds5

About N-(3,4,5-trimethoxyphenyl)methanesulfonamide

N-(3,4,5-trimethoxyphenyl)methanesulfonamide (PubChem CID 2991852) has the molecular formula C10H15NO5S and a molecular weight of 261.30 g/mol. Its IUPAC name is N-(3,4,5-trimethoxyphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(3,4,5-trimethoxyphenyl)methanesulfonamide
PubChem CID2991852
Molecular FormulaC10H15NO5S
Molecular Weight261.30 g/mol
Exact Mass261.07
IUPAC NameN-(3,4,5-trimethoxyphenyl)methanesulfonamide
SMILESCOc1cc(NS(C)(=O)=O)cc(OC)c1OC
InChIInChI=1S/C10H15NO5S/c1-14-8-5-7(11-17(4,12)13)6-9(15-2)10(8)16-3/h5-6,11H,1-4H3
InChIKeyGNVPPYRMRUWSPJ-UHFFFAOYSA-N
XLogP1.08
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3,4,5-trimethoxyphenyl)methanesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3,4,5-trimethoxyphenyl)methanesulfonamide?
The IUPAC name of N-(3,4,5-trimethoxyphenyl)methanesulfonamide (CID 2991852) is N-(3,4,5-trimethoxyphenyl)methanesulfonamide.
What is the SMILES notation for N-(3,4,5-trimethoxyphenyl)methanesulfonamide?
The canonical SMILES for N-(3,4,5-trimethoxyphenyl)methanesulfonamide is COc1cc(NS(C)(=O)=O)cc(OC)c1OC.
What is the InChIKey of N-(3,4,5-trimethoxyphenyl)methanesulfonamide?
The InChIKey is GNVPPYRMRUWSPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO5S/c1-14-8-5-7(11-17(4,12)13)6-9(15-2)10(8)16-3/h5-6,11H,1-4H3.
What are the key properties of N-(3,4,5-trimethoxyphenyl)methanesulfonamide?
N-(3,4,5-trimethoxyphenyl)methanesulfonamide has a molecular weight of 261.30 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4,5-trimethoxyphenyl)methanesulfonamide is sourced from PubChem (CID 2991852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).