(6-ethoxynaphthalen-2-yl)methylidenehydrazine

C13H14N2O — CID 168529332

IUPAC(6-ethoxynaphthalen-2-yl)methylidenehydrazine
SMILESCCOc1ccc2cc(C=NN)ccc2c1
InChIInChI=1S/C13H14N2O/c1-2-16-13-6-5-11-7-10(9-15-14)3-4-12(11)8-13/h3-9H,2,14H2,1H3
InChIKeyOVKNFXIFOCUHFV-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.53
Rot. Bonds3

About (6-ethoxynaphthalen-2-yl)methylidenehydrazine

(6-ethoxynaphthalen-2-yl)methylidenehydrazine (PubChem CID 168529332) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is (6-ethoxynaphthalen-2-yl)methylidenehydrazine.

Molecular Properties

Compound Name(6-ethoxynaphthalen-2-yl)methylidenehydrazine
PubChem CID168529332
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name(6-ethoxynaphthalen-2-yl)methylidenehydrazine
SMILESCCOc1ccc2cc(C=NN)ccc2c1
InChIInChI=1S/C13H14N2O/c1-2-16-13-6-5-11-7-10(9-15-14)3-4-12(11)8-13/h3-9H,2,14H2,1H3
InChIKeyOVKNFXIFOCUHFV-UHFFFAOYSA-N
XLogP2.53
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6-ethoxynaphthalen-2-yl)methylidenehydrazine?
The IUPAC name of (6-ethoxynaphthalen-2-yl)methylidenehydrazine (CID 168529332) is (6-ethoxynaphthalen-2-yl)methylidenehydrazine.
What is the SMILES notation for (6-ethoxynaphthalen-2-yl)methylidenehydrazine?
The canonical SMILES for (6-ethoxynaphthalen-2-yl)methylidenehydrazine is CCOc1ccc2cc(C=NN)ccc2c1.
What is the InChIKey of (6-ethoxynaphthalen-2-yl)methylidenehydrazine?
The InChIKey is OVKNFXIFOCUHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-2-16-13-6-5-11-7-10(9-15-14)3-4-12(11)8-13/h3-9H,2,14H2,1H3.
What are the key properties of (6-ethoxynaphthalen-2-yl)methylidenehydrazine?
(6-ethoxynaphthalen-2-yl)methylidenehydrazine has a molecular weight of 214.27 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethoxynaphthalen-2-yl)methylidenehydrazine is sourced from PubChem (CID 168529332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).