4-(naphthalen-1-yloxymethyl)benzohydrazide

C18H16N2O2 — CID 948904

IUPAC4-(naphthalen-1-yloxymethyl)benzohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3ccccc23)cc1
InChIInChI=1S/C18H16N2O2/c19-20-18(21)15-10-8-13(9-11-15)12-22-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12,19H2,(H,20,21)
InChIKeyWMGAPIPYCFIIMD-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.02
Rot. Bonds4

About 4-(naphthalen-1-yloxymethyl)benzohydrazide

4-(naphthalen-1-yloxymethyl)benzohydrazide (PubChem CID 948904) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-(naphthalen-1-yloxymethyl)benzohydrazide.

Molecular Properties

Compound Name4-(naphthalen-1-yloxymethyl)benzohydrazide
PubChem CID948904
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name4-(naphthalen-1-yloxymethyl)benzohydrazide
SMILESNNC(=O)c1ccc(COc2cccc3ccccc23)cc1
InChIInChI=1S/C18H16N2O2/c19-20-18(21)15-10-8-13(9-11-15)12-22-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12,19H2,(H,20,21)
InChIKeyWMGAPIPYCFIIMD-UHFFFAOYSA-N
XLogP3.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[[2-(hydroxymethyl)phenoxy]methyl]benzohydrazide
CID 63679637
1-[4-(naphthalen-1-yloxymethyl)phenyl]ethanone
CID 134094222
4-[(2,6-dimethylphenoxy)methyl]benzohydrazide
CID 7174125
4-(naphthalen-1-ylmethoxy)benzohydrazide
CID 91683225
4-[(4-phenylphenoxy)methyl]benzohydrazide
CID 2368822
3-(naphthalen-1-yloxymethyl)-N-propan-2-ylbenzamide
CID 891835
4-[(2-chloro-4-fluorophenoxy)methyl]benzohydrazide
CID 63576415
3-bromo-4-phenylmethoxybenzohydrazide
CID 54793170
4-[(3-bromophenoxy)methyl]benzohydrazide
CID 63575146
4-[(3-chlorophenoxy)methyl]benzohydrazide
CID 7022246
5-(naphthalen-1-yloxymethyl)pyridine-2-carboxylic acid
CID 118428749
1-(naphthalen-2-ylmethoxy)naphthalene
CID 132511538

Frequently Asked Questions

What is the IUPAC name of 4-(naphthalen-1-yloxymethyl)benzohydrazide?
The IUPAC name of 4-(naphthalen-1-yloxymethyl)benzohydrazide (CID 948904) is 4-(naphthalen-1-yloxymethyl)benzohydrazide.
What is the SMILES notation for 4-(naphthalen-1-yloxymethyl)benzohydrazide?
The canonical SMILES for 4-(naphthalen-1-yloxymethyl)benzohydrazide is NNC(=O)c1ccc(COc2cccc3ccccc23)cc1.
What is the InChIKey of 4-(naphthalen-1-yloxymethyl)benzohydrazide?
The InChIKey is WMGAPIPYCFIIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c19-20-18(21)15-10-8-13(9-11-15)12-22-17-7-3-5-14-4-1-2-6-16(14)17/h1-11H,12,19H2,(H,20,21).
What are the key properties of 4-(naphthalen-1-yloxymethyl)benzohydrazide?
4-(naphthalen-1-yloxymethyl)benzohydrazide has a molecular weight of 292.34 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(naphthalen-1-yloxymethyl)benzohydrazide is sourced from PubChem (CID 948904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).