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

C9H6N6O2 — CID 13026898

IUPAC5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESN#Cc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C9H6N6O2/c10-4-5-1-2-7(16)6(3-5)8(17)11-9-12-14-15-13-9/h1-3,16H,(H2,11,12,13,14,15,17)
InChIKeyYQSILTNITZENTD-UHFFFAOYSA-N
MW230.19 g/mol
LogP0.03
Rot. Bonds2

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

5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 13026898) has the molecular formula C9H6N6O2 and a molecular weight of 230.19 g/mol. Its IUPAC name is 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID13026898
Molecular FormulaC9H6N6O2
Molecular Weight230.19 g/mol
Exact Mass230.06
IUPAC Name5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESN#Cc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1
InChIInChI=1S/C9H6N6O2/c10-4-5-1-2-7(16)6(3-5)8(17)11-9-12-14-15-13-9/h1-3,16H,(H2,11,12,13,14,15,17)
InChIKeyYQSILTNITZENTD-UHFFFAOYSA-N
XLogP0.03
TPSA127.58 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 811323
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
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
3-acetyl-5-tert-butyl-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 13026888
3-Acetyl-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 13026889

Frequently Asked Questions

What is the IUPAC name of 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (CID 13026898) is 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is N#Cc1ccc(O)c(C(=O)Nc2nn[nH]n2)c1.
What is the InChIKey of 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is YQSILTNITZENTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N6O2/c10-4-5-1-2-7(16)6(3-5)8(17)11-9-12-14-15-13-9/h1-3,16H,(H2,11,12,13,14,15,17).
What are the key properties of 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 230.19 g/mol, XLogP of 0.03, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 13026898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).