3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide

C19H16N2O3 — CID 877479

IUPAC3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1
InChIInChI=1S/C19H16N2O3/c1-12-6-8-13(9-7-12)18(23)20-21-19(24)16-10-14-4-2-3-5-15(14)11-17(16)22/h2-11,22H,1H3,(H,20,23)(H,21,24)
InChIKeyFMOSIBLEMIFIFS-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.93
Rot. Bonds2

About 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide

3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide (PubChem CID 877479) has the molecular formula C19H16N2O3 and a molecular weight of 320.35 g/mol. Its IUPAC name is 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide.

Molecular Properties

Compound Name3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide
PubChem CID877479
Molecular FormulaC19H16N2O3
Molecular Weight320.35 g/mol
Exact Mass320.12
IUPAC Name3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1
InChIInChI=1S/C19H16N2O3/c1-12-6-8-13(9-7-12)18(23)20-21-19(24)16-10-14-4-2-3-5-15(14)11-17(16)22/h2-11,22H,1H3,(H,20,23)(H,21,24)
InChIKeyFMOSIBLEMIFIFS-UHFFFAOYSA-N
XLogP2.93
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Hydroxy-2-naphthoic acid hydrazide
CID 72699
Dynasore
CID 135533054
N'-cyclohexylidene-3-hydroxynaphthalene-2-carbohydrazide
CID 795531
Naphthalene-2-carboxylic acid N'-(2-methoxy-benzoyl)-hydrazide
CID 789947
1-hydroxy-N'-(4-methoxybenzoyl)-2-naphthohydrazide
CID 774191
N'-(2-hydroxybenzoyl)naphthalene-1-carbohydrazide
CID 22613412
2-Hydroxy-1-naphthylaldehyde 3-fluorobenzoylhydrazone
CID 135412822
2-Hydroxy-1-naphthalaldehyde salicyloylhydrazone
CID 135458654
3-Hydroxy-2-naphthalenecarboxamide
CID 19317
4-Methylbenzoic (2-hydroxy-1-naphthylmethylene)hydrazide
CID 135407190
N'-(1,3-dimethylbutylidene)-3-hydroxy-2-naphthohydrazide
CID 5779530
1,3,10,11,12-Pentahydroxy-6-methyltetracene-2-carboxamide
CID 441107

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide?
The IUPAC name of 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide (CID 877479) is 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide.
What is the SMILES notation for 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide?
The canonical SMILES for 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide is Cc1ccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1.
What is the InChIKey of 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide?
The InChIKey is FMOSIBLEMIFIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O3/c1-12-6-8-13(9-7-12)18(23)20-21-19(24)16-10-14-4-2-3-5-15(14)11-17(16)22/h2-11,22H,1H3,(H,20,23)(H,21,24).
What are the key properties of 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide?
3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide has a molecular weight of 320.35 g/mol, XLogP of 2.93, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N'-(4-methylbenzoyl)naphthalene-2-carbohydrazide is sourced from PubChem (CID 877479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).