2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol

C15H15ClN2O2 — CID 135616077

IUPAC2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol
SMILESCCOc1ccc(/C=N/Nc2ccccc2Cl)c(O)c1
InChIInChI=1S/C15H15ClN2O2/c1-2-20-12-8-7-11(15(19)9-12)10-17-18-14-6-4-3-5-13(14)16/h3-10,18-19H,2H2,1H3/b17-10+
InChIKeyBSEJQUXFIWNXIY-LICLKQGHSA-N
MW290.75 g/mol
LogP3.89
Rot. Bonds5

About 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol

2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol (PubChem CID 135616077) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol.

Molecular Properties

Compound Name2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol
PubChem CID135616077
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol
SMILESCCOc1ccc(/C=N/Nc2ccccc2Cl)c(O)c1
InChIInChI=1S/C15H15ClN2O2/c1-2-20-12-8-7-11(15(19)9-12)10-17-18-14-6-4-3-5-13(14)16/h3-10,18-19H,2H2,1H3/b17-10+
InChIKeyBSEJQUXFIWNXIY-LICLKQGHSA-N
XLogP3.89
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[(3-chloro-4-methylphenyl)hydrazinylidene]methyl]-5-ethoxyphenol
CID 4674688
2-[[(3-chloropyrazin-2-yl)hydrazinylidene]methyl]-5-ethoxyphenol
CID 3099406
5-ethoxy-2-[(E)-[(3-methylphenyl)hydrazinylidene]methyl]phenol
CID 135676045
2-[(E)-[(4,6-diphenylpyrimidin-2-yl)hydrazinylidene]methyl]-5-ethoxyphenol
CID 135822458
2-[[[2-chloro-5-(trifluoromethyl)phenyl]hydrazinylidene]methyl]-5-propoxyphenol
CID 4662927
2-[(phenylhydrazinylidene)methyl]-5-(2,2,2-trifluoroethoxy)phenol
CID 169383696
N-[(E)-(4-ethoxy-2-hydroxyphenyl)methylideneamino]-2-(4-phenylphenoxy)acetamide
CID 135590241
2-[[(6-chloro-2-methylpyrimidin-4-yl)hydrazinylidene]methyl]-5-propoxyphenol
CID 3099282
2-[(E)-[(3-chloropyrazin-2-yl)hydrazinylidene]methyl]-5-propoxyphenol
CID 135504514
2-chloro-N-[(Z)-(2,4-diethoxyphenyl)methylideneamino]benzamide
CID 110509275
N-[(E)-(4-ethoxy-2-hydroxyphenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 135533021
2-[(Z)-(phenylhydrazinylidene)methyl]-5-propan-2-yloxyphenol
CID 137068734

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol?
The IUPAC name of 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol (CID 135616077) is 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol.
What is the SMILES notation for 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol?
The canonical SMILES for 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol is CCOc1ccc(/C=N/Nc2ccccc2Cl)c(O)c1.
What is the InChIKey of 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol?
The InChIKey is BSEJQUXFIWNXIY-LICLKQGHSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-2-20-12-8-7-11(15(19)9-12)10-17-18-14-6-4-3-5-13(14)16/h3-10,18-19H,2H2,1H3/b17-10+.
What are the key properties of 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol?
2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol has a molecular weight of 290.75 g/mol, XLogP of 3.89, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-[(2-chlorophenyl)hydrazinylidene]methyl]-5-ethoxyphenol is sourced from PubChem (CID 135616077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).