3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide

C19H16N2O5 — CID 24774049

IUPAC3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1O
InChIInChI=1S/C19H16N2O5/c1-26-16-8-4-7-13(17(16)23)18(24)20-21-19(25)14-9-11-5-2-3-6-12(11)10-15(14)22/h2-10,22-23H,1H3,(H,20,24)(H,21,25)
InChIKeyLJKODLIXTOFTIJ-UHFFFAOYSA-N
MW352.35 g/mol
LogP2.33
Rot. Bonds3

About 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide

3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide (PubChem CID 24774049) has the molecular formula C19H16N2O5 and a molecular weight of 352.35 g/mol. Its IUPAC name is 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide.

Molecular Properties

Compound Name3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide
PubChem CID24774049
Molecular FormulaC19H16N2O5
Molecular Weight352.35 g/mol
Exact Mass352.11
IUPAC Name3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1O
InChIInChI=1S/C19H16N2O5/c1-26-16-8-4-7-13(17(16)23)18(24)20-21-19(25)14-9-11-5-2-3-6-12(11)10-15(14)22/h2-10,22-23H,1H3,(H,20,24)(H,21,25)
InChIKeyLJKODLIXTOFTIJ-UHFFFAOYSA-N
XLogP2.33
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.35
LogP ≤ 52.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide?
The IUPAC name of 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide (CID 24774049) is 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide.
What is the SMILES notation for 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide?
The canonical SMILES for 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide is COc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1O.
What is the InChIKey of 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide?
The InChIKey is LJKODLIXTOFTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O5/c1-26-16-8-4-7-13(17(16)23)18(24)20-21-19(25)14-9-11-5-2-3-6-12(11)10-15(14)22/h2-10,22-23H,1H3,(H,20,24)(H,21,25).
What are the key properties of 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide?
3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide has a molecular weight of 352.35 g/mol, XLogP of 2.33, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N'-(2-hydroxy-3-methoxybenzoyl)naphthalene-2-carbohydrazide is sourced from PubChem (CID 24774049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).