N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide

C17H11N3O3 — CID 166765860

IUPACN'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide
SMILESO=C(NNC(=O)c1c(O)c#cc2ccccc12)c1cccnc1
InChIInChI=1S/C17H11N3O3/c21-14-8-7-11-4-1-2-6-13(11)15(14)17(23)20-19-16(22)12-5-3-9-18-10-12/h1-6,9-10,21H,(H,19,22)(H,20,23)
InChIKeyJCPXYHSABIYIQT-UHFFFAOYSA-N
MW305.29 g/mol
LogP1.62
Rot. Bonds2

About N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide

N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide (PubChem CID 166765860) has the molecular formula C17H11N3O3 and a molecular weight of 305.29 g/mol. Its IUPAC name is N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide
PubChem CID166765860
Molecular FormulaC17H11N3O3
Molecular Weight305.29 g/mol
Exact Mass305.08
IUPAC NameN'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide
SMILESO=C(NNC(=O)c1c(O)c#cc2ccccc12)c1cccnc1
InChIInChI=1S/C17H11N3O3/c21-14-8-7-11-4-1-2-6-13(11)15(14)17(23)20-19-16(22)12-5-3-9-18-10-12/h1-6,9-10,21H,(H,19,22)(H,20,23)
InChIKeyJCPXYHSABIYIQT-UHFFFAOYSA-N
XLogP1.62
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.29
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-hydroxynaphthalene-1-carbonyl)pyridine-3-carbohydrazide
CID 153395646
N'-(4-iodobenzoyl)pyridine-3-carbohydrazide
CID 19166393
N'-pyridin-2-ylpyridine-3-carbohydrazide
CID 69416476
1-naphthalen-1-yl-3-(pyridine-3-carbonylamino)urea
CID 1225748
N'-(4-oxo-4-phenylbutanoyl)pyridine-3-carbohydrazide
CID 35152458
1-phenyl-2-pyridin-3-ylethane-1,2-dione
CID 10987556
N'-(2-amino-2-methylpropanoyl)pyridine-3-carbohydrazide
CID 67519841
N'-[4-(dimethylamino)benzoyl]pyridine-3-carbohydrazide
CID 25342800
N-methylpyridine-3-carboxamide chloride
CID 20976730
N-benzylpyridine-3-carboxamide chloride
CID 21204170
N-[[4-[(pyridine-3-carbonylamino)carbamoyl]phenyl]methyl]acetamide
CID 32688575
N'-[2-(2-methylphenyl)acetyl]pyridine-3-carbohydrazide
CID 35152193

Frequently Asked Questions

What is the IUPAC name of N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide?
The IUPAC name of N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide (CID 166765860) is N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide.
What is the SMILES notation for N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide?
The canonical SMILES for N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide is O=C(NNC(=O)c1c(O)c#cc2ccccc12)c1cccnc1.
What is the InChIKey of N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide?
The InChIKey is JCPXYHSABIYIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O3/c21-14-8-7-11-4-1-2-6-13(11)15(14)17(23)20-19-16(22)12-5-3-9-18-10-12/h1-6,9-10,21H,(H,19,22)(H,20,23).
What are the key properties of N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide?
N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide has a molecular weight of 305.29 g/mol, XLogP of 1.62, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-hydroxy-3,4-didehydronaphthalene-1-carbonyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 166765860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).