N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide

C14H17NO6S — CID 110759282

IUPACN-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide
SMILESCOc1cc(OC)c(S(=O)(=O)NCc2ccco2)c(OC)c1
InChIInChI=1S/C14H17NO6S/c1-18-11-7-12(19-2)14(13(8-11)20-3)22(16,17)15-9-10-5-4-6-21-10/h4-8,15H,9H2,1-3H3
InChIKeyRKVRNSKDIYAWPM-UHFFFAOYSA-N
MW327.36 g/mol
LogP1.78
Rot. Bonds7

About N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide

N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide (PubChem CID 110759282) has the molecular formula C14H17NO6S and a molecular weight of 327.36 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide
PubChem CID110759282
Molecular FormulaC14H17NO6S
Molecular Weight327.36 g/mol
Exact Mass327.08
IUPAC NameN-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide
SMILESCOc1cc(OC)c(S(=O)(=O)NCc2ccco2)c(OC)c1
InChIInChI=1S/C14H17NO6S/c1-18-11-7-12(19-2)14(13(8-11)20-3)22(16,17)15-9-10-5-4-6-21-10/h4-8,15H,9H2,1-3H3
InChIKeyRKVRNSKDIYAWPM-UHFFFAOYSA-N
XLogP1.78
TPSA87.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.36
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide 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

2,3,5,6-tetrafluoro-N-(furan-2-ylmethyl)-4-methoxybenzenesulfonamide
CID 18191791
5-chloro-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 686051
5-acetyl-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 39445497
5-(furan-2-ylmethylsulfamoyl)-2-methoxybenzamide
CID 34027934
N-[5-(furan-2-ylmethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 2991258
4-bromo-2,6-dichloro-N-(furan-2-ylmethyl)benzenesulfonamide
CID 26944366
(2S)-2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(furan-2-ylmethyl)propanamide
CID 110348354
N-(furan-2-ylmethyl)-2,4-dimethoxybenzamide
CID 3118683
N-(5-chloro-2-methoxyphenyl)-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 4793263
5-ethoxy-N-(furan-2-ylmethyl)-2,4-dimethylbenzenesulfonamide
CID 934715
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-2-(3-methoxyphenyl)acetamide
CID 24639742
2,4,6-trimethoxybenzenesulfonohydrazide
CID 96666055

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide (CID 110759282) is N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide is COc1cc(OC)c(S(=O)(=O)NCc2ccco2)c(OC)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide?
The InChIKey is RKVRNSKDIYAWPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO6S/c1-18-11-7-12(19-2)14(13(8-11)20-3)22(16,17)15-9-10-5-4-6-21-10/h4-8,15H,9H2,1-3H3.
What are the key properties of N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide?
N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide has a molecular weight of 327.36 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2,4,6-trimethoxybenzenesulfonamide is sourced from PubChem (CID 110759282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).