3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide

C21H20N2O4 — CID 24585783

IUPAC3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide
SMILESCCOc1cc2ccccc2cc1C(=O)NNC(=O)c1ccc(OC)cc1
InChIInChI=1S/C21H20N2O4/c1-3-27-19-13-16-7-5-4-6-15(16)12-18(19)21(25)23-22-20(24)14-8-10-17(26-2)11-9-14/h4-13H,3H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyVIILIRJRFDZGBS-UHFFFAOYSA-N
MW364.40 g/mol
LogP3.32
Rot. Bonds5

About 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide

3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide (PubChem CID 24585783) has the molecular formula C21H20N2O4 and a molecular weight of 364.40 g/mol. Its IUPAC name is 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide.

Molecular Properties

Compound Name3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide
PubChem CID24585783
Molecular FormulaC21H20N2O4
Molecular Weight364.40 g/mol
Exact Mass364.14
IUPAC Name3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide
SMILESCCOc1cc2ccccc2cc1C(=O)NNC(=O)c1ccc(OC)cc1
InChIInChI=1S/C21H20N2O4/c1-3-27-19-13-16-7-5-4-6-15(16)12-18(19)21(25)23-22-20(24)14-8-10-17(26-2)11-9-14/h4-13H,3H2,1-2H3,(H,22,24)(H,23,25)
InChIKeyVIILIRJRFDZGBS-UHFFFAOYSA-N
XLogP3.32
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-hydroxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide
CID 806093
2-ethoxy-N'-[1-(4-methoxyphenyl)ethenyl]benzohydrazide
CID 5052026
methyl 2-[(3-ethoxynaphthalene-2-carbonyl)amino]benzoate
CID 18093375
3-methoxy-N'-(4-nitrobenzoyl)naphthalene-2-carbohydrazide
CID 9314825
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
N'-[2-(4-ethylphenoxy)acetyl]-3-methoxynaphthalene-2-carbohydrazide
CID 18225115
1-(4-chlorophenyl)-3-[(3-ethoxynaphthalene-2-carbonyl)amino]thiourea
CID 142738438
N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
CID 4926525
(2-methoxyphenyl) 3-ethoxynaphthalene-2-carboxylate
CID 24505759
N'-(4-ethoxybenzoyl)-3-methoxy-4-phenylmethoxybenzohydrazide
CID 9492724
2-oxo-N'-(3,4,5-triethoxybenzoyl)chromene-3-carbohydrazide
CID 34250417
4-ethoxy-3-methoxy-N'-(2-naphthalen-2-ylacetyl)benzohydrazide
CID 9439837

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide?
The IUPAC name of 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide (CID 24585783) is 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide.
What is the SMILES notation for 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide?
The canonical SMILES for 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide is CCOc1cc2ccccc2cc1C(=O)NNC(=O)c1ccc(OC)cc1.
What is the InChIKey of 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide?
The InChIKey is VIILIRJRFDZGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4/c1-3-27-19-13-16-7-5-4-6-15(16)12-18(19)21(25)23-22-20(24)14-8-10-17(26-2)11-9-14/h4-13H,3H2,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide?
3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide has a molecular weight of 364.40 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N'-(4-methoxybenzoyl)naphthalene-2-carbohydrazide is sourced from PubChem (CID 24585783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).