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

C8H8N6O2 — CID 135703076

IUPAC5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESNc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C8H8N6O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,9H2,(H2,10,11,12,13,14,16)
InChIKeyPLWNRKIOONHLRJ-UHFFFAOYSA-N
MW220.19 g/mol
LogP-0.26
Rot. Bonds2

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

5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 135703076) has the molecular formula C8H8N6O2 and a molecular weight of 220.19 g/mol. Its IUPAC name is 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID135703076
Molecular FormulaC8H8N6O2
Molecular Weight220.19 g/mol
Exact Mass220.07
IUPAC Name5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESNc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C8H8N6O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,9H2,(H2,10,11,12,13,14,16)
InChIKeyPLWNRKIOONHLRJ-UHFFFAOYSA-N
XLogP-0.26
TPSA129.81 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.19
LogP ≤ 5-0.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (CID 135703076) is 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is Nc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1.
What is the InChIKey of 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is PLWNRKIOONHLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N6O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,9H2,(H2,10,11,12,13,14,16).
What are the key properties of 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 220.19 g/mol, XLogP of -0.26, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 135703076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).