2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide

C8H7N5O3 — CID 135703077

IUPAC2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1cc(O)ccc1O
InChIInChI=1S/C8H7N5O3/c14-4-1-2-6(15)5(3-4)7(16)9-8-10-12-13-11-8/h1-3,14-15H,(H2,9,10,11,12,13,16)
InChIKeyGBZNZWZXQJSDNX-UHFFFAOYSA-N
MW221.18 g/mol
LogP-0.14
Rot. Bonds2

About 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide

2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 135703077) has the molecular formula C8H7N5O3 and a molecular weight of 221.18 g/mol. Its IUPAC name is 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID135703077
Molecular FormulaC8H7N5O3
Molecular Weight221.18 g/mol
Exact Mass221.05
IUPAC Name2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1cc(O)ccc1O
InChIInChI=1S/C8H7N5O3/c14-4-1-2-6(15)5(3-4)7(16)9-8-10-12-13-11-8/h1-3,14-15H,(H2,9,10,11,12,13,16)
InChIKeyGBZNZWZXQJSDNX-UHFFFAOYSA-N
XLogP-0.14
TPSA124.02 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.18
LogP ≤ 5-0.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 811323
2-hydroxy-3-methoxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962760
5-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962771
2-hydroxy-5-phenyl-N-(2H-tetrazol-5-yl)benzamide
CID 12962776
5-bromo-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962777
5-acetyl-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962778
5-chloro-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 12962781
2-hydroxy-5-methyl-N-(2H-tetrazol-5-yl)benzamide
CID 12962784
2-hydroxy-5-methoxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962789
3-acetyl-2-hydroxy-5-methyl-N-(2H-tetrazol-5-yl)benzamide
CID 13026871
5-trifluoromethyl-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 13026884
3-acetyl-5-ethyl-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 13026885

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide (CID 135703077) is 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide is O=C(Nc1nn[nH]n1)c1cc(O)ccc1O.
What is the InChIKey of 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is GBZNZWZXQJSDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N5O3/c14-4-1-2-6(15)5(3-4)7(16)9-8-10-12-13-11-8/h1-3,14-15H,(H2,9,10,11,12,13,16).
What are the key properties of 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide?
2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 221.18 g/mol, XLogP of -0.14, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 135703077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).