5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide

C14H18N2O2S2 — CID 61474831

IUPAC5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
SMILESCc1ccc(N)cc1S(=O)(=O)NC(C)Cc1ccsc1
InChIInChI=1S/C14H18N2O2S2/c1-10-3-4-13(15)8-14(10)20(17,18)16-11(2)7-12-5-6-19-9-12/h3-6,8-9,11,16H,7,15H2,1-2H3
InChIKeyWVZWHTJPGMGGEY-UHFFFAOYSA-N
MW310.44 g/mol
LogP2.55
Rot. Bonds5

About 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide

5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide (PubChem CID 61474831) has the molecular formula C14H18N2O2S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
PubChem CID61474831
Molecular FormulaC14H18N2O2S2
Molecular Weight310.44 g/mol
Exact Mass310.08
IUPAC Name5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
SMILESCc1ccc(N)cc1S(=O)(=O)NC(C)Cc1ccsc1
InChIInChI=1S/C14H18N2O2S2/c1-10-3-4-13(15)8-14(10)20(17,18)16-11(2)7-12-5-6-19-9-12/h3-6,8-9,11,16H,7,15H2,1-2H3
InChIKeyWVZWHTJPGMGGEY-UHFFFAOYSA-N
XLogP2.55
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-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-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474983
5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54954014
5-amino-2-methyl-N-(5-methylhexan-2-yl)benzenesulfonamide
CID 43576401
2-(aminomethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 106053233
2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 47358916
2-(methylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 62152021
3-amino-1-ethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazole-4-sulfonamide
CID 61474909
5-amino-N-(1-hydroxyethyl)-2-methylbenzenesulfonamide
CID 66751883
4-amino-3-methoxy-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 81440427
3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
CID 103305478
5-bromo-2-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 61223337
6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 64602655

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The IUPAC name of 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide (CID 61474831) is 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide.
What is the SMILES notation for 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The canonical SMILES for 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide is Cc1ccc(N)cc1S(=O)(=O)NC(C)Cc1ccsc1.
What is the InChIKey of 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
The InChIKey is WVZWHTJPGMGGEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S2/c1-10-3-4-13(15)8-14(10)20(17,18)16-11(2)7-12-5-6-19-9-12/h3-6,8-9,11,16H,7,15H2,1-2H3.
What are the key properties of 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide?
5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide has a molecular weight of 310.44 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide is sourced from PubChem (CID 61474831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).