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

C8H6ClN5O2 — CID 12962781

IUPAC5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1cc(Cl)ccc1O
InChIInChI=1S/C8H6ClN5O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,(H2,10,11,12,13,14,16)
InChIKeySTNPJUMAUMDUSL-UHFFFAOYSA-N
MW239.62 g/mol
LogP0.81
Rot. Bonds2

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

5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 12962781) has the molecular formula C8H6ClN5O2 and a molecular weight of 239.62 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID12962781
Molecular FormulaC8H6ClN5O2
Molecular Weight239.62 g/mol
Exact Mass239.02
IUPAC Name5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1cc(Cl)ccc1O
InChIInChI=1S/C8H6ClN5O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,(H2,10,11,12,13,14,16)
InChIKeySTNPJUMAUMDUSL-UHFFFAOYSA-N
XLogP0.81
TPSA103.79 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.62
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 648937
2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 811323
3-acetyl-5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962762
5-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962771
2-hydroxy-5-methyl-N-(2H-tetrazol-5-yl)benzamide
CID 12962784
5-trifluoromethyl-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 13026884
3-Acetyl-2-hydroxy-N-(tetrazol-5-yl)benzamide
CID 13026889
5-cyano-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 13026898
2,5-dihydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 135703077
5-chloro-2-hydroxy-N-(1,2,4-triazol-1-yl)benzamide
CID 6481047
5-chloro-2-hydroxy-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 3440372
N''-(5-chloro-2-hydroxybenzoyl)-N-(2-phenylethyl)guanidine
CID 3447392

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (CID 12962781) is 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is O=C(Nc1nn[nH]n1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is STNPJUMAUMDUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClN5O2/c9-4-1-2-6(15)5(3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,(H2,10,11,12,13,14,16).
What are the key properties of 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 239.62 g/mol, XLogP of 0.81, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 12962781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).