5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide

C13H15ClN2O4S — CID 106056911

IUPAC5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide
SMILESCOc1cc(Cl)c(C)cc1NS(=O)(=O)c1ccc(CN)o1
InChIInChI=1S/C13H15ClN2O4S/c1-8-5-11(12(19-2)6-10(8)14)16-21(17,18)13-4-3-9(7-15)20-13/h3-6,16H,7,15H2,1-2H3
InChIKeyKYFICNBULXJEKE-UHFFFAOYSA-N
MW330.79 g/mol
LogP2.51
Rot. Bonds5

About 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide

5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide (PubChem CID 106056911) has the molecular formula C13H15ClN2O4S and a molecular weight of 330.79 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide
PubChem CID106056911
Molecular FormulaC13H15ClN2O4S
Molecular Weight330.79 g/mol
Exact Mass330.04
IUPAC Name5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide
SMILESCOc1cc(Cl)c(C)cc1NS(=O)(=O)c1ccc(CN)o1
InChIInChI=1S/C13H15ClN2O4S/c1-8-5-11(12(19-2)6-10(8)14)16-21(17,18)13-4-3-9(7-15)20-13/h3-6,16H,7,15H2,1-2H3
InChIKeyKYFICNBULXJEKE-UHFFFAOYSA-N
XLogP2.51
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.79
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide 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

5-(aminomethyl)-N-(3-chloro-4-methoxyphenyl)furan-2-sulfonamide
CID 106048091
4-bromo-N-(4-chloro-2-methoxy-5-methylphenyl)benzenesulfonamide
CID 60641377
N-(4-chloro-2-methoxy-5-methylphenyl)-4-propan-2-ylbenzenesulfonamide
CID 30156649
4-acetyl-N-(4-chloro-2-methoxy-5-methylphenyl)benzenesulfonamide
CID 7940785
N-(4-chloro-2-methoxy-5-methylphenyl)thiophene-2-sulfonamide
CID 8523500
4-amino-N-(4-chloro-2-methoxy-5-methylphenyl)butane-1-sulfonamide
CID 106056915
5-tert-butyl-N-(4-chloro-2-methoxy-5-methylphenyl)-2-methylbenzenesulfonamide
CID 7940782
N-(4-chloro-2-methoxy-5-methylphenyl)-2,4-difluorobenzenesulfonamide
CID 8523503
N-(4-chloro-2-methoxy-5-methylphenyl)-2,3,4-trifluorobenzenesulfonamide
CID 8523518
2-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-1,3-thiazole-5-sulfonamide
CID 43427486
N-(4-chloro-2-methoxy-5-methylphenyl)-1,4-dimethylpyrazole-5-sulfonamide
CID 146124559
5-(aminomethyl)-2-bromo-N-(2-bromo-5-chloro-4-methylphenyl)furan-3-sulfonamide
CID 106078945

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide (CID 106056911) is 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide is COc1cc(Cl)c(C)cc1NS(=O)(=O)c1ccc(CN)o1.
What is the InChIKey of 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide?
The InChIKey is KYFICNBULXJEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O4S/c1-8-5-11(12(19-2)6-10(8)14)16-21(17,18)13-4-3-9(7-15)20-13/h3-6,16H,7,15H2,1-2H3.
What are the key properties of 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide?
5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide has a molecular weight of 330.79 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(4-chloro-2-methoxy-5-methylphenyl)furan-2-sulfonamide is sourced from PubChem (CID 106056911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).