2-amino-N-(2H-tetrazol-5-yl)benzamide

C8H8N6O — CID 13267895

IUPAC2-amino-N-(2H-tetrazol-5-yl)benzamide
SMILESNc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C8H8N6O/c9-6-4-2-1-3-5(6)7(15)10-8-11-13-14-12-8/h1-4H,9H2,(H2,10,11,12,13,14,15)
InChIKeyGOXQERQFQMSLJU-UHFFFAOYSA-N
MW204.19 g/mol
LogP0.03
Rot. Bonds2

About 2-amino-N-(2H-tetrazol-5-yl)benzamide

2-amino-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 13267895) has the molecular formula C8H8N6O and a molecular weight of 204.19 g/mol. Its IUPAC name is 2-amino-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-amino-N-(2H-tetrazol-5-yl)benzamide
PubChem CID13267895
Molecular FormulaC8H8N6O
Molecular Weight204.19 g/mol
Exact Mass204.08
IUPAC Name2-amino-N-(2H-tetrazol-5-yl)benzamide
SMILESNc1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C8H8N6O/c9-6-4-2-1-3-5(6)7(15)10-8-11-13-14-12-8/h1-4H,9H2,(H2,10,11,12,13,14,15)
InChIKeyGOXQERQFQMSLJU-UHFFFAOYSA-N
XLogP0.03
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-amino-N-(2H-tetrazol-5-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 2-amino-N-(2H-tetrazol-5-yl)benzamide (CID 13267895) is 2-amino-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 2-amino-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 2-amino-N-(2H-tetrazol-5-yl)benzamide is Nc1ccccc1C(=O)Nc1nn[nH]n1.
What is the InChIKey of 2-amino-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is GOXQERQFQMSLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N6O/c9-6-4-2-1-3-5(6)7(15)10-8-11-13-14-12-8/h1-4H,9H2,(H2,10,11,12,13,14,15).
What are the key properties of 2-amino-N-(2H-tetrazol-5-yl)benzamide?
2-amino-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 204.19 g/mol, XLogP of 0.03, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 13267895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).