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

C17H16N6O2 — CID 33001295

IUPAC2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2cccc(-n3cnnn3)c2)cc1
InChIInChI=1S/C17H16N6O2/c1-12(24)19-14-7-5-13(6-8-14)9-17(25)20-15-3-2-4-16(10-15)23-11-18-21-22-23/h2-8,10-11H,9H2,1H3,(H,19,24)(H,20,25)
InChIKeyJTBPWQQLDLPIKS-UHFFFAOYSA-N
MW336.36 g/mol
LogP1.80
Rot. Bonds5

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

2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 33001295) has the molecular formula C17H16N6O2 and a molecular weight of 336.36 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
PubChem CID33001295
Molecular FormulaC17H16N6O2
Molecular Weight336.36 g/mol
Exact Mass336.13
IUPAC Name2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2cccc(-n3cnnn3)c2)cc1
InChIInChI=1S/C17H16N6O2/c1-12(24)19-14-7-5-13(6-8-14)9-17(25)20-15-3-2-4-16(10-15)23-11-18-21-22-23/h2-8,10-11H,9H2,1H3,(H,19,24)(H,20,25)
InChIKeyJTBPWQQLDLPIKS-UHFFFAOYSA-N
XLogP1.80
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(4-acetamidophenyl)-N-[3-(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-bromo-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 63681198
2-(2,6-dichlorophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 7692890
3-(4-ethylphenyl)-N-[3-(tetrazol-1-yl)phenyl]propanamide
CID 31891602
4-(4-ethylphenyl)-4-oxo-N-[3-(tetrazol-1-yl)phenyl]butanamide
CID 34549027
2-propan-2-yloxy-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 47418203
2-(3,4-dimethylphenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 18079837
N-(4-fluorophenyl)-2-[3-(tetrazol-1-yl)anilino]acetamide
CID 25344863
2-ethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide
CID 47097708
5-amino-4-methyl-N-[3-(tetrazol-1-yl)phenyl]pentanamide
CID 82012333
2-[1-(2-hydroxyethyl)-3,5-dimethylpyrazol-4-yl]-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 146021420
N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 55651820
N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 91954160

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide (CID 33001295) is 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide is CC(=O)Nc1ccc(CC(=O)Nc2cccc(-n3cnnn3)c2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is JTBPWQQLDLPIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O2/c1-12(24)19-14-7-5-13(6-8-14)9-17(25)20-15-3-2-4-16(10-15)23-11-18-21-22-23/h2-8,10-11H,9H2,1H3,(H,19,24)(H,20,25).
What are the key properties of 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 336.36 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 33001295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).