3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide

C17H18N6O2S — CID 130230712

IUPAC3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide
SMILESCc1ccc(-c2cccc3c2CC(N)C3)c(-c2nn[nH]n2)c1S(N)(=O)=O
InChIInChI=1S/C17H18N6O2S/c1-9-5-6-13(12-4-2-3-10-7-11(18)8-14(10)12)15(16(9)26(19,24)25)17-20-22-23-21-17/h2-6,11H,7-8,18H2,1H3,(H2,19,24,25)(H,20,21,22,23)
InChIKeyMJEANLXGKUGBFX-UHFFFAOYSA-N
MW370.44 g/mol
LogP0.92
Rot. Bonds3

About 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide

3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide (PubChem CID 130230712) has the molecular formula C17H18N6O2S and a molecular weight of 370.44 g/mol. Its IUPAC name is 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide
PubChem CID130230712
Molecular FormulaC17H18N6O2S
Molecular Weight370.44 g/mol
Exact Mass370.12
IUPAC Name3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide
SMILESCc1ccc(-c2cccc3c2CC(N)C3)c(-c2nn[nH]n2)c1S(N)(=O)=O
InChIInChI=1S/C17H18N6O2S/c1-9-5-6-13(12-4-2-3-10-7-11(18)8-14(10)12)15(16(9)26(19,24)25)17-20-22-23-21-17/h2-6,11H,7-8,18H2,1H3,(H2,19,24,25)(H,20,21,22,23)
InChIKeyMJEANLXGKUGBFX-UHFFFAOYSA-N
XLogP0.92
TPSA140.64 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.44
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-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

6-methyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 122694383
4-[4-methyl-3-sulfamoyl-2-(2H-tetrazol-5-yl)phenyl]cyclohexane-1-carboximidamide
CID 122694432
3-(7-azaspiro[3.5]nonan-7-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 130230599
6-bromo-3-(4-methylphenyl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 118266420
6-(azetidin-3-ylsulfonyl)-3-quinolin-8-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 135150190
6-(azetidin-3-ylsulfonyl)-3-(1-methylindazol-4-yl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 135149883
3-(2-amino-3-cyanophenyl)-6-(azetidin-3-ylsulfinyl)-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 145219938
2-(2H-tetrazol-5-yl)-3-[4-(2H-tetrazol-5-yl)phenyl]benzenesulfonamide
CID 122687798
3-[4-(aminomethyl)phenyl]-6-bromo-2-(2H-tetrazol-5-yl)benzenesulfonamide;ethane
CID 144893208
3-(2-amino-1H-benzimidazol-4-yl)-6-(4-aminocyclohexyl)sulfanyl-2-(2H-tetrazol-5-yl)benzenesulfonamide;propa-1,2-diene
CID 145214925
3-(2-amino-1,3-benzothiazol-4-yl)-6-[(3R)-3-aminopyrrolidin-1-yl]sulfonyl-2-(2H-tetrazol-5-yl)benzenesulfonamide
CID 135311128
6-(azetidin-3-ylsulfonyl)-3-quinolin-8-yl-2-(2H-tetrazol-5-yl)benzenesulfonamide;formaldehyde
CID 145220005

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The IUPAC name of 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide (CID 130230712) is 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The canonical SMILES for 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide is Cc1ccc(-c2cccc3c2CC(N)C3)c(-c2nn[nH]n2)c1S(N)(=O)=O.
What is the InChIKey of 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
The InChIKey is MJEANLXGKUGBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O2S/c1-9-5-6-13(12-4-2-3-10-7-11(18)8-14(10)12)15(16(9)26(19,24)25)17-20-22-23-21-17/h2-6,11H,7-8,18H2,1H3,(H2,19,24,25)(H,20,21,22,23).
What are the key properties of 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide?
3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide has a molecular weight of 370.44 g/mol, XLogP of 0.92, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2,3-dihydro-1H-inden-4-yl)-6-methyl-2-(2H-tetrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 130230712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).