5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide

C13H10N6O2 — CID 63860092

IUPAC5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-n2cnnn2)c1)c1cncc(O)c1
InChIInChI=1S/C13H10N6O2/c20-12-4-9(6-14-7-12)13(21)16-10-2-1-3-11(5-10)19-8-15-17-18-19/h1-8,20H,(H,16,21)
InChIKeyDGBKKGIPRCATAH-UHFFFAOYSA-N
MW282.26 g/mol
LogP1.02
Rot. Bonds3

About 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide

5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide (PubChem CID 63860092) has the molecular formula C13H10N6O2 and a molecular weight of 282.26 g/mol. Its IUPAC name is 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide
PubChem CID63860092
Molecular FormulaC13H10N6O2
Molecular Weight282.26 g/mol
Exact Mass282.09
IUPAC Name5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccc(-n2cnnn2)c1)c1cncc(O)c1
InChIInChI=1S/C13H10N6O2/c20-12-4-9(6-14-7-12)13(21)16-10-2-1-3-11(5-10)19-8-15-17-18-19/h1-8,20H,(H,16,21)
InChIKeyDGBKKGIPRCATAH-UHFFFAOYSA-N
XLogP1.02
TPSA105.82 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide (CID 63860092) is 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide is O=C(Nc1cccc(-n2cnnn2)c1)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is DGBKKGIPRCATAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N6O2/c20-12-4-9(6-14-7-12)13(21)16-10-2-1-3-11(5-10)19-8-15-17-18-19/h1-8,20H,(H,16,21).
What are the key properties of 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide?
5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 282.26 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[3-(tetrazol-1-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 63860092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).