2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide

C12H11N3O2 — CID 82521335

IUPAC2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide
SMILESNNC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C12H11N3O2/c13-15-12(17)9-6-7-10(14-11(9)16)8-4-2-1-3-5-8/h1-7H,13H2,(H,14,16)(H,15,17)
InChIKeyBKBLLZNOAKZRTF-UHFFFAOYSA-N
MW229.24 g/mol
LogP0.65
Rot. Bonds2

About 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide

2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide (PubChem CID 82521335) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide
PubChem CID82521335
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC Name2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide
SMILESNNC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C12H11N3O2/c13-15-12(17)9-6-7-10(14-11(9)16)8-4-2-1-3-5-8/h1-7H,13H2,(H,14,16)(H,15,17)
InChIKeyBKBLLZNOAKZRTF-UHFFFAOYSA-N
XLogP0.65
TPSA87.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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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Related Compounds

N-(2-cyanoethyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 129350671
2-oxo-6-(3-propoxyphenyl)-1H-pyridine-3-carbohydrazide
CID 82518239
N-(2-ethyl-2-hydroxybutyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 111483420
N-(1-amino-2,3-dimethylbutan-2-yl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide;hydrochloride
CID 119607556
N-(2-ethylphenyl)-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66498057
2-oxo-6-phenyl-N-(4-propylphenyl)-1H-pyridine-3-carboxamide
CID 112830494
N-(2-hydroxy-2,3-dimethylbutyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 111484299
N-[1-(methylamino)-1-oxopropan-2-yl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 138041610
N-(3,4-difluorophenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497927
N-(4-ethoxyphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497881
2-oxo-6-phenyl-N-(1H-pyrazol-4-yl)-1H-pyridine-3-carboxamide
CID 60506694
N-(2,5-dimethylphenyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 66497845

Frequently Asked Questions

What is the IUPAC name of 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide?
The IUPAC name of 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide (CID 82521335) is 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide.
What is the SMILES notation for 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide?
The canonical SMILES for 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide is NNC(=O)c1ccc(-c2ccccc2)[nH]c1=O.
What is the InChIKey of 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide?
The InChIKey is BKBLLZNOAKZRTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c13-15-12(17)9-6-7-10(14-11(9)16)8-4-2-1-3-5-8/h1-7H,13H2,(H,14,16)(H,15,17).
What are the key properties of 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide?
2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide has a molecular weight of 229.24 g/mol, XLogP of 0.65, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-6-phenyl-1H-pyridine-3-carbohydrazide is sourced from PubChem (CID 82521335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).