N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide

C22H20N2O3 — CID 4925965

IUPACN'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C22H20N2O3/c1-2-14-27-19-12-10-17(11-13-19)22(26)24-23-21(25)15-18-8-5-7-16-6-3-4-9-20(16)18/h2-13H,1,14-15H2,(H,23,25)(H,24,26)
InChIKeyOKHBFCUAWCCWLO-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.41
Rot. Bonds6

About N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide

N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide (PubChem CID 4925965) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide.

Molecular Properties

Compound NameN'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide
PubChem CID4925965
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC NameN'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C22H20N2O3/c1-2-14-27-19-12-10-17(11-13-19)22(26)24-23-21(25)15-18-8-5-7-16-6-3-4-9-20(16)18/h2-13H,1,14-15H2,(H,23,25)(H,24,26)
InChIKeyOKHBFCUAWCCWLO-UHFFFAOYSA-N
XLogP3.41
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-naphthalen-1-yl-N-(4-prop-2-enoxyphenyl)acetamide
CID 4952511
4-chloro-N'-(2-naphthalen-1-ylacetyl)benzohydrazide
CID 3396166
1-N',9-N'-bis(4-prop-2-enoxybenzoyl)nonanedihydrazide
CID 4926340
2-naphthalen-1-yl-N'-[2-(4-phenylphenoxy)acetyl]acetohydrazide
CID 4513399
N'-(2-naphthalen-1-ylacetyl)pyridine-4-carbohydrazide
CID 4807892
2-naphthalen-1-yl-N-(3-prop-2-enoxyphenyl)acetamide
CID 17086689
4-(2-methoxyethoxy)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]benzamide
CID 17353949
N'-(4-bromobenzoyl)-4-prop-2-enoxybenzohydrazide
CID 54790852
N'-[2-(4-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
CID 4925883
3-(2-phenoxyethoxy)-N'-(4-prop-2-enoxybenzoyl)benzohydrazide
CID 4955159
4-(naphthalen-1-ylmethoxy)benzohydrazide
CID 91683225
4-(2-methylpropoxy)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]benzamide
CID 4937739

Frequently Asked Questions

What is the IUPAC name of N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide?
The IUPAC name of N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide (CID 4925965) is N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide.
What is the SMILES notation for N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide?
The canonical SMILES for N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide is C=CCOc1ccc(C(=O)NNC(=O)Cc2cccc3ccccc23)cc1.
What is the InChIKey of N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide?
The InChIKey is OKHBFCUAWCCWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-2-14-27-19-12-10-17(11-13-19)22(26)24-23-21(25)15-18-8-5-7-16-6-3-4-9-20(16)18/h2-13H,1,14-15H2,(H,23,25)(H,24,26).
What are the key properties of N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide?
N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide has a molecular weight of 360.41 g/mol, XLogP of 3.41, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-naphthalen-1-ylacetyl)-4-prop-2-enoxybenzohydrazide is sourced from PubChem (CID 4925965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).