3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide

C20H18N2O4 — CID 27567090

IUPAC3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2cc3ccccc3cc2O)c1
InChIInChI=1S/C20H18N2O4/c1-13-5-4-8-16(9-13)26-12-19(24)21-22-20(25)17-10-14-6-2-3-7-15(14)11-18(17)23/h2-11,23H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyGZAVLISTTKGFSK-UHFFFAOYSA-N
MW350.37 g/mol
LogP2.69
Rot. Bonds4

About 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide

3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide (PubChem CID 27567090) has the molecular formula C20H18N2O4 and a molecular weight of 350.37 g/mol. Its IUPAC name is 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide.

Molecular Properties

Compound Name3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide
PubChem CID27567090
Molecular FormulaC20H18N2O4
Molecular Weight350.37 g/mol
Exact Mass350.13
IUPAC Name3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2cc3ccccc3cc2O)c1
InChIInChI=1S/C20H18N2O4/c1-13-5-4-8-16(9-13)26-12-19(24)21-22-20(25)17-10-14-6-2-3-7-15(14)11-18(17)23/h2-11,23H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyGZAVLISTTKGFSK-UHFFFAOYSA-N
XLogP2.69
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 52.69
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

2-hydroxy-4-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 51193302
N-[3-[[[2-(3-methylphenoxy)acetyl]amino]carbamoyl]naphthalen-2-yl]cyclopropanecarboxamide
CID 55429366
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
N'-[2-(3-methylphenoxy)acetyl]-2-propoxybenzohydrazide
CID 4931604
4-benzoyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 7601018
methyl 3-[2-[2-(3-methylphenoxy)acetyl]hydrazinyl]-3-oxopropanoate
CID 28638195
N-[3-[[[2-(3-methylphenoxy)acetyl]amino]carbamoyl]naphthalen-2-yl]thiophene-2-sulfonamide
CID 24664130
N'-[2-(3,5-dimethylphenoxy)acetyl]-1-hydroxynaphthalene-2-carbohydrazide
CID 1372554
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
2-chloro-4-fluoro-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 51146468
3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]-4-nitrobenzohydrazide
CID 24538802
2-(2-cyanophenyl)-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 34656833

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide?
The IUPAC name of 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide (CID 27567090) is 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide.
What is the SMILES notation for 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide?
The canonical SMILES for 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide is Cc1cccc(OCC(=O)NNC(=O)c2cc3ccccc3cc2O)c1.
What is the InChIKey of 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide?
The InChIKey is GZAVLISTTKGFSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4/c1-13-5-4-8-16(9-13)26-12-19(24)21-22-20(25)17-10-14-6-2-3-7-15(14)11-18(17)23/h2-11,23H,12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide?
3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide has a molecular weight of 350.37 g/mol, XLogP of 2.69, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide is sourced from PubChem (CID 27567090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).