1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide

C13H13N5O4 — CID 3062426

IUPAC1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide
SMILESNNC(=O)c1cc(=O)cc(C(=O)NN)n1-c1ccc(O)cc1
InChIInChI=1S/C13H13N5O4/c14-16-12(21)10-5-9(20)6-11(13(22)17-15)18(10)7-1-3-8(19)4-2-7/h1-6,19H,14-15H2,(H,16,21)(H,17,22)
InChIKeyGQGUCVVGPREABM-UHFFFAOYSA-N
MW303.28 g/mol
LogP-1.25
Rot. Bonds3

About 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide

1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide (PubChem CID 3062426) has the molecular formula C13H13N5O4 and a molecular weight of 303.28 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide
PubChem CID3062426
Molecular FormulaC13H13N5O4
Molecular Weight303.28 g/mol
Exact Mass303.10
IUPAC Name1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide
SMILESNNC(=O)c1cc(=O)cc(C(=O)NN)n1-c1ccc(O)cc1
InChIInChI=1S/C13H13N5O4/c14-16-12(21)10-5-9(20)6-11(13(22)17-15)18(10)7-1-3-8(19)4-2-7/h1-6,19H,14-15H2,(H,16,21)(H,17,22)
InChIKeyGQGUCVVGPREABM-UHFFFAOYSA-N
XLogP-1.25
TPSA152.47 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.28
LogP ≤ 5-1.25
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide?
The IUPAC name of 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide (CID 3062426) is 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide.
What is the SMILES notation for 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide?
The canonical SMILES for 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide is NNC(=O)c1cc(=O)cc(C(=O)NN)n1-c1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide?
The InChIKey is GQGUCVVGPREABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O4/c14-16-12(21)10-5-9(20)6-11(13(22)17-15)18(10)7-1-3-8(19)4-2-7/h1-6,19H,14-15H2,(H,16,21)(H,17,22).
What are the key properties of 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide?
1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide has a molecular weight of 303.28 g/mol, XLogP of -1.25, 3 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-4-oxopyridine-2,6-dicarbohydrazide is sourced from PubChem (CID 3062426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).