2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol

C19H21NO2 — CID 135657451

IUPAC2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol
SMILESCCOc1cccc(/C=N/c2cccc3c2CCCC3)c1O
InChIInChI=1S/C19H21NO2/c1-2-22-18-12-6-9-15(19(18)21)13-20-17-11-5-8-14-7-3-4-10-16(14)17/h5-6,8-9,11-13,21H,2-4,7,10H2,1H3/b20-13+
InChIKeyZIBDAJYSXYKYBW-DEDYPNTBSA-N
MW295.38 g/mol
LogP4.42
Rot. Bonds4

About 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol

2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol (PubChem CID 135657451) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol.

Molecular Properties

Compound Name2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol
PubChem CID135657451
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol
SMILESCCOc1cccc(/C=N/c2cccc3c2CCCC3)c1O
InChIInChI=1S/C19H21NO2/c1-2-22-18-12-6-9-15(19(18)21)13-20-17-11-5-8-14-7-3-4-10-16(14)17/h5-6,8-9,11-13,21H,2-4,7,10H2,1H3/b20-13+
InChIKeyZIBDAJYSXYKYBW-DEDYPNTBSA-N
XLogP4.42
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yliminomethyl)-6-ethoxyphenol
CID 135595869
2-ethoxy-6-[(2-iodophenyl)iminomethyl]phenol
CID 135595102
1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
CID 139088664
2-[(2,6-dimethylphenyl)iminomethyl]-6-ethoxyphenol
CID 135657455
2-[(2,4-dimethylphenyl)iminomethyl]-6-ethoxyphenol
CID 135657453
2-ethoxy-6-[[2-(trifluoromethyl)phenyl]iminomethyl]phenol
CID 135657486
2-[(2,5-diethoxyphenyl)iminomethyl]-6-ethoxyphenol
CID 135657460
2-ethoxy-6-(phenyliminomethyl)phenol
CID 135657442
2-[(2,4-difluorophenyl)iminomethyl]-6-ethoxyphenol
CID 135595380
2-ethoxy-6-(isoquinolin-5-yliminomethyl)phenol
CID 135760992
2-ethoxy-6-[(E)-pyridin-2-yliminomethyl]phenol
CID 135515677
2-[(2-chloro-5-fluorophenyl)iminomethyl]-6-ethoxyphenol
CID 135657485

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol?
The IUPAC name of 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol (CID 135657451) is 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol.
What is the SMILES notation for 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol?
The canonical SMILES for 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol is CCOc1cccc(/C=N/c2cccc3c2CCCC3)c1O.
What is the InChIKey of 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol?
The InChIKey is ZIBDAJYSXYKYBW-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H21NO2/c1-2-22-18-12-6-9-15(19(18)21)13-20-17-11-5-8-14-7-3-4-10-16(14)17/h5-6,8-9,11-13,21H,2-4,7,10H2,1H3/b20-13+.
What are the key properties of 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol?
2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol has a molecular weight of 295.38 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol is sourced from PubChem (CID 135657451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).