2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol

C19H17NO3 — CID 1284379

IUPAC2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol
SMILESCOc1cc(/C=N/c2ccc3ccccc3c2)cc(OC)c1O
InChIInChI=1S/C19H17NO3/c1-22-17-9-13(10-18(23-2)19(17)21)12-20-16-8-7-14-5-3-4-6-15(14)11-16/h3-12,21H,1-2H3/b20-12+
InChIKeyADLDNGOHDJHIMT-UDWIEESQSA-N
MW307.35 g/mol
LogP4.31
Rot. Bonds4

About 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol

2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol (PubChem CID 1284379) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol.

Molecular Properties

Compound Name2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol
PubChem CID1284379
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol
SMILESCOc1cc(/C=N/c2ccc3ccccc3c2)cc(OC)c1O
InChIInChI=1S/C19H17NO3/c1-22-17-9-13(10-18(23-2)19(17)21)12-20-16-8-7-14-5-3-4-6-15(14)11-16/h3-12,21H,1-2H3/b20-12+
InChIKeyADLDNGOHDJHIMT-UDWIEESQSA-N
XLogP4.31
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-iodo-6-methoxy-4-[(4-phenoxyphenyl)iminomethyl]phenol
CID 137149845
2,6-dimethoxy-4-[(E)-[methyl(phenyl)hydrazinylidene]methyl]phenol
CID 135779670
N-(4-phenoxyphenyl)-1-(3,4,5-trimethoxyphenyl)methanimine
CID 4505600
2-bromo-4-[(4-ethylphenyl)iminomethyl]-6-methoxyphenol
CID 137021949
4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol
CID 2344023
4-(naphthalen-2-yliminomethyl)-N,N-bis[4-(naphthalen-2-yliminomethyl)phenyl]aniline
CID 102053185
[2-methoxy-4-(naphthalen-2-yliminomethyl)phenyl] 4-octoxybenzoate
CID 101084547
4-[(3-chloro-4-methylphenyl)iminomethyl]-2-iodo-6-methoxyphenol
CID 137149832
N-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]-2-phenoxyacetamide
CID 135738473
1-(4-methoxyphenyl)-N-[3-[(4-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 18527961
4-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2,6-dimethoxyphenol
CID 71361751
(4-methoxyphenyl)-naphthalen-2-yldiazene
CID 572318

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol?
The IUPAC name of 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol (CID 1284379) is 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol.
What is the SMILES notation for 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol?
The canonical SMILES for 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol is COc1cc(/C=N/c2ccc3ccccc3c2)cc(OC)c1O.
What is the InChIKey of 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol?
The InChIKey is ADLDNGOHDJHIMT-UDWIEESQSA-N. The full InChI is InChI=1S/C19H17NO3/c1-22-17-9-13(10-18(23-2)19(17)21)12-20-16-8-7-14-5-3-4-6-15(14)11-16/h3-12,21H,1-2H3/b20-12+.
What are the key properties of 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol?
2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol has a molecular weight of 307.35 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol is sourced from PubChem (CID 1284379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).