N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide

C20H24N6O3S — CID 91954160

IUPACN-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCC(C)CNS(=O)(=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnn3)cc2)c1
InChIInChI=1S/C20H24N6O3S/c1-15(2)12-22-30(28,29)13-17-4-3-5-18(10-17)23-20(27)11-16-6-8-19(9-7-16)26-14-21-24-25-26/h3-10,14-15,22H,11-13H2,1-2H3,(H,23,27)
InChIKeyHGURGJBNBRZGRQ-UHFFFAOYSA-N
MW428.52 g/mol
LogP1.92
Rot. Bonds9

About N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide

N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 91954160) has the molecular formula C20H24N6O3S and a molecular weight of 428.52 g/mol. Its IUPAC name is N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID91954160
Molecular FormulaC20H24N6O3S
Molecular Weight428.52 g/mol
Exact Mass428.16
IUPAC NameN-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCC(C)CNS(=O)(=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnn3)cc2)c1
InChIInChI=1S/C20H24N6O3S/c1-15(2)12-22-30(28,29)13-17-4-3-5-18(10-17)23-20(27)11-16-6-8-19(9-7-16)26-14-21-24-25-26/h3-10,14-15,22H,11-13H2,1-2H3,(H,23,27)
InChIKeyHGURGJBNBRZGRQ-UHFFFAOYSA-N
XLogP1.92
TPSA118.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.52
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide 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-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 33001295
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 78862634
N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55630981
2-(3,4-dimethylphenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 18079837
N-[2-(2-methylpropoxy)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55887932
N-(9-ethylcarbazol-3-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 52576497
N-[4-[[2-[4-(tetrazol-1-yl)phenyl]acetyl]amino]phenyl]furan-2-carboxamide
CID 30896780
N-[4-(2,4-dimethylphenyl)sulfanylphenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 30876231
2-propan-2-yloxy-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 47418203
N-[4-[methoxy(methyl)sulfamoyl]phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55633392
N-[4-chloro-3-[ethyl(phenyl)sulfamoyl]phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55631238
2-(2,6-dichlorophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 7692890

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide (CID 91954160) is N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide is CC(C)CNS(=O)(=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnn3)cc2)c1.
What is the InChIKey of N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is HGURGJBNBRZGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O3S/c1-15(2)12-22-30(28,29)13-17-4-3-5-18(10-17)23-20(27)11-16-6-8-19(9-7-16)26-14-21-24-25-26/h3-10,14-15,22H,11-13H2,1-2H3,(H,23,27).
What are the key properties of N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 428.52 g/mol, XLogP of 1.92, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 91954160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).