2-(2-aminoethyliminomethyl)-6-methoxyphenol

C10H14N2O2 — CID 136729153

IUPAC2-(2-aminoethyliminomethyl)-6-methoxyphenol
SMILESCOc1cccc(/C=N/CCN)c1O
InChIInChI=1S/C10H14N2O2/c1-14-9-4-2-3-8(10(9)13)7-12-6-5-11/h2-4,7,13H,5-6,11H2,1H3/b12-7+
InChIKeyBROIQFDYZZJWMF-KPKJPENVSA-N
MW194.23 g/mol
LogP0.78
Rot. Bonds4

About 2-(2-aminoethyliminomethyl)-6-methoxyphenol

2-(2-aminoethyliminomethyl)-6-methoxyphenol (PubChem CID 136729153) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(2-aminoethyliminomethyl)-6-methoxyphenol.

Molecular Properties

Compound Name2-(2-aminoethyliminomethyl)-6-methoxyphenol
PubChem CID136729153
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-(2-aminoethyliminomethyl)-6-methoxyphenol
SMILESCOc1cccc(/C=N/CCN)c1O
InChIInChI=1S/C10H14N2O2/c1-14-9-4-2-3-8(10(9)13)7-12-6-5-11/h2-4,7,13H,5-6,11H2,1H3/b12-7+
InChIKeyBROIQFDYZZJWMF-KPKJPENVSA-N
XLogP0.78
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-aminoethyliminomethyl)-6-methoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[(2-hydroxy-3-methoxyphenyl)methylideneamino]butyliminomethyl]-6-methoxyphenol
CID 609617
2-[6-[(2-hydroxy-3-methoxyphenyl)methylideneamino]hexyliminomethyl]-6-methoxyphenol
CID 136851289
2-(3-hydroxypropyliminomethyl)-6-methoxyphenol
CID 136727735
2-[2-[bis[2-[(2-hydroxy-3-methoxyphenyl)methylideneamino]ethyl]amino]ethyliminomethyl]-6-methoxyphenol
CID 135509884
2-[2-(dihydroxyamino)ethyliminomethyl]-6-methoxyphenol
CID 136908274
2-[2-(4-chlorophenoxy)ethyliminomethyl]-6-methoxyphenol
CID 135817980
2-[(E)-[(E)-(2-hydroxy-3-methoxyphenyl)methylidenehydrazinylidene]methyl]-6-methoxyphenol
CID 135473163
2-[2-(3-chlorophenyl)ethyliminomethyl]-6-methoxyphenol
CID 135757817
2-[2-(4-chlorophenyl)sulfanylethyliminomethyl]-6-methoxyphenol
CID 135847622
2-[(E)-hydroxyiminomethyl]-6-methoxyphenol
CID 135460299
manganese(2+);2-methanehydrazonoyl-6-methoxyphenol;dichloride
CID 162116939
2-[2-(2-bromo-4,5-dimethoxyphenyl)ethyliminomethyl]-6-methoxyphenol
CID 135855450

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyliminomethyl)-6-methoxyphenol?
The IUPAC name of 2-(2-aminoethyliminomethyl)-6-methoxyphenol (CID 136729153) is 2-(2-aminoethyliminomethyl)-6-methoxyphenol.
What is the SMILES notation for 2-(2-aminoethyliminomethyl)-6-methoxyphenol?
The canonical SMILES for 2-(2-aminoethyliminomethyl)-6-methoxyphenol is COc1cccc(/C=N/CCN)c1O.
What is the InChIKey of 2-(2-aminoethyliminomethyl)-6-methoxyphenol?
The InChIKey is BROIQFDYZZJWMF-KPKJPENVSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-14-9-4-2-3-8(10(9)13)7-12-6-5-11/h2-4,7,13H,5-6,11H2,1H3/b12-7+.
What are the key properties of 2-(2-aminoethyliminomethyl)-6-methoxyphenol?
2-(2-aminoethyliminomethyl)-6-methoxyphenol has a molecular weight of 194.23 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyliminomethyl)-6-methoxyphenol is sourced from PubChem (CID 136729153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).