2-(ethyliminomethyl)-5-methoxyphenol

C10H13NO2 — CID 144549332

IUPAC2-(ethyliminomethyl)-5-methoxyphenol
SMILESCC/N=C/c1ccc(OC)cc1O
InChIInChI=1S/C10H13NO2/c1-3-11-7-8-4-5-9(13-2)6-10(8)12/h4-7,12H,3H2,1-2H3/b11-7+
InChIKeyUMDNMMOWKXDIFA-YRNVUSSQSA-N
MW179.22 g/mol
LogP1.84
Rot. Bonds3

About 2-(ethyliminomethyl)-5-methoxyphenol

2-(ethyliminomethyl)-5-methoxyphenol (PubChem CID 144549332) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-(ethyliminomethyl)-5-methoxyphenol.

Molecular Properties

Compound Name2-(ethyliminomethyl)-5-methoxyphenol
PubChem CID144549332
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2-(ethyliminomethyl)-5-methoxyphenol
SMILESCC/N=C/c1ccc(OC)cc1O
InChIInChI=1S/C10H13NO2/c1-3-11-7-8-4-5-9(13-2)6-10(8)12/h4-7,12H,3H2,1-2H3/b11-7+
InChIKeyUMDNMMOWKXDIFA-YRNVUSSQSA-N
XLogP1.84
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.84
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-[10-[(2-hydroxy-4-methoxyphenyl)methylideneamino]decyliminomethyl]-5-methoxyphenol
CID 136618032
acetic acid;2-[2-[(2-hydroxy-4-methoxyphenyl)methylideneamino]ethyliminomethyl]-5-methoxyphenol;manganese
CID 135509459
5-methoxy-2-[(E)-prop-1-enyl]phenol
CID 18539717
N-ethyl-1-(4-methoxyphenyl)methanimine
CID 12927006
(2S)-2-[(2-hydroxy-4-methoxyphenyl)methylideneamino]-4-methylpentanoic acid
CID 135937367
2-[(2-bromophenyl)iminomethyl]-5-methoxyphenol
CID 137224260
2-[[3-[(2-hydroxy-5-methoxyphenyl)methylideneamino]-2,2-dimethylpropyl]iminomethyl]-4-methoxyphenol
CID 137231962
4-methoxy-2-(2-sulfanylethyliminomethyl)phenol
CID 137210775
2-[[1-[2-[(2-hydroxy-4-methoxyphenyl)methylideneamino]naphthalen-1-yl]naphthalen-2-yl]iminomethyl]-5-methoxyphenol
CID 136721460
2-[[(2S)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]iminomethyl]-5-propoxyphenol
CID 135596420
2-(octadecyliminomethyl)-5-undecoxyphenol
CID 136694989
5-hexoxy-2-(hexyliminomethyl)phenol
CID 136673235

Frequently Asked Questions

What is the IUPAC name of 2-(ethyliminomethyl)-5-methoxyphenol?
The IUPAC name of 2-(ethyliminomethyl)-5-methoxyphenol (CID 144549332) is 2-(ethyliminomethyl)-5-methoxyphenol.
What is the SMILES notation for 2-(ethyliminomethyl)-5-methoxyphenol?
The canonical SMILES for 2-(ethyliminomethyl)-5-methoxyphenol is CC/N=C/c1ccc(OC)cc1O.
What is the InChIKey of 2-(ethyliminomethyl)-5-methoxyphenol?
The InChIKey is UMDNMMOWKXDIFA-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H13NO2/c1-3-11-7-8-4-5-9(13-2)6-10(8)12/h4-7,12H,3H2,1-2H3/b11-7+.
What are the key properties of 2-(ethyliminomethyl)-5-methoxyphenol?
2-(ethyliminomethyl)-5-methoxyphenol has a molecular weight of 179.22 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethyliminomethyl)-5-methoxyphenol is sourced from PubChem (CID 144549332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).