2-[(2,6-dimethylphenyl)methylideneamino]ethanol

C11H15NO — CID 141084157

IUPAC2-[(2,6-dimethylphenyl)methylideneamino]ethanol
SMILESCc1cccc(C)c1/C=N/CCO
InChIInChI=1S/C11H15NO/c1-9-4-3-5-10(2)11(9)8-12-6-7-13/h3-5,8,13H,6-7H2,1-2H3/b12-8+
InChIKeyMPHQBWIIKIISQU-XYOKQWHBSA-N
MW177.25 g/mol
LogP1.71
Rot. Bonds3

About 2-[(2,6-dimethylphenyl)methylideneamino]ethanol

2-[(2,6-dimethylphenyl)methylideneamino]ethanol (PubChem CID 141084157) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-[(2,6-dimethylphenyl)methylideneamino]ethanol.

Molecular Properties

Compound Name2-[(2,6-dimethylphenyl)methylideneamino]ethanol
PubChem CID141084157
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2-[(2,6-dimethylphenyl)methylideneamino]ethanol
SMILESCc1cccc(C)c1/C=N/CCO
InChIInChI=1S/C11H15NO/c1-9-4-3-5-10(2)11(9)8-12-6-7-13/h3-5,8,13H,6-7H2,1-2H3/b12-8+
InChIKeyMPHQBWIIKIISQU-XYOKQWHBSA-N
XLogP1.71
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-[(2,6-dimethylphenyl)methylideneamino]ethanol 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-[(6-methyl-2-pyridinyl)methylideneamino]ethanol
CID 102086230
2-(2-hydroxyethyliminomethyl)-5-methoxy-3-methylphenol
CID 176997824
2-[(2,6-dimethylphenyl)methylideneamino]guanidine
CID 72725816
3-(2-hydroxyethyliminomethyl)-1H-indol-2-ol
CID 2034851
1-(2,6-dimethylphenyl)-N-naphthalen-1-ylmethanimine
CID 71530075
zinc bis(2-(2-hydroxyethyliminomethyl)-6-methoxyphenolate)
CID 139072510
dichlorozirconium;2-[3-[(2-hydroxy-3-methylphenyl)methylideneamino]propyliminomethyl]-6-methylphenol
CID 135997406
3-methyl-2-(propan-2-yliminomethyl)phenol
CID 137212346
3-(anthracen-9-ylmethylideneamino)propan-1-ol
CID 4598040
[3-methyl-2-[(Z)-2-(methylideneamino)prop-1-enyl]phenyl]methanol
CID 143569641
(NZ)-N-[(2-methyl-6-prop-2-ynylphenyl)methylidene]hydroxylamine
CID 173289314
1-(2-chloro-6-methylphenyl)-N-(3,4-dihydro-2H-pyrrol-5-ylmethyl)methanimine
CID 157177558

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethylphenyl)methylideneamino]ethanol?
The IUPAC name of 2-[(2,6-dimethylphenyl)methylideneamino]ethanol (CID 141084157) is 2-[(2,6-dimethylphenyl)methylideneamino]ethanol.
What is the SMILES notation for 2-[(2,6-dimethylphenyl)methylideneamino]ethanol?
The canonical SMILES for 2-[(2,6-dimethylphenyl)methylideneamino]ethanol is Cc1cccc(C)c1/C=N/CCO.
What is the InChIKey of 2-[(2,6-dimethylphenyl)methylideneamino]ethanol?
The InChIKey is MPHQBWIIKIISQU-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H15NO/c1-9-4-3-5-10(2)11(9)8-12-6-7-13/h3-5,8,13H,6-7H2,1-2H3/b12-8+.
What are the key properties of 2-[(2,6-dimethylphenyl)methylideneamino]ethanol?
2-[(2,6-dimethylphenyl)methylideneamino]ethanol has a molecular weight of 177.25 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethylphenyl)methylideneamino]ethanol is sourced from PubChem (CID 141084157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).