4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide

C8H6FN5O2 — CID 12962770

IUPAC4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1ccc(F)cc1O
InChIInChI=1S/C8H6FN5O2/c9-4-1-2-5(6(15)3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,(H2,10,11,12,13,14,16)
InChIKeyHSUIPWUAHYBECM-UHFFFAOYSA-N
MW223.17 g/mol
LogP0.30
Rot. Bonds2

About 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide

4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (PubChem CID 12962770) has the molecular formula C8H6FN5O2 and a molecular weight of 223.17 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
PubChem CID12962770
Molecular FormulaC8H6FN5O2
Molecular Weight223.17 g/mol
Exact Mass223.05
IUPAC Name4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
SMILESO=C(Nc1nn[nH]n1)c1ccc(F)cc1O
InChIInChI=1S/C8H6FN5O2/c9-4-1-2-5(6(15)3-4)7(16)10-8-11-13-14-12-8/h1-3,15H,(H2,10,11,12,13,14,16)
InChIKeyHSUIPWUAHYBECM-UHFFFAOYSA-N
XLogP0.30
TPSA103.79 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.17
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide (CID 12962770) is 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is O=C(Nc1nn[nH]n1)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
The InChIKey is HSUIPWUAHYBECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN5O2/c9-4-1-2-5(6(15)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 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide?
4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide has a molecular weight of 223.17 g/mol, XLogP of 0.30, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide is sourced from PubChem (CID 12962770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).