[2-(1-methoxyethyl)phenyl]methanimine

C10H13NO — CID 20711806

IUPAC[2-(1-methoxyethyl)phenyl]methanimine
SMILES[H]/N=C/c1ccccc1C(C)OC
InChIInChI=1S/C10H13NO/c1-8(12-2)10-6-4-3-5-9(10)7-11/h3-8,11H,1-2H3/b11-7+
InChIKeyUHQSCGRNJYPFEA-YRNVUSSQSA-N
MW163.22 g/mol
LogP2.39
Rot. Bonds3

About [2-(1-methoxyethyl)phenyl]methanimine

[2-(1-methoxyethyl)phenyl]methanimine (PubChem CID 20711806) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is [2-(1-methoxyethyl)phenyl]methanimine.

Molecular Properties

Compound Name[2-(1-methoxyethyl)phenyl]methanimine
PubChem CID20711806
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name[2-(1-methoxyethyl)phenyl]methanimine
SMILES[H]/N=C/c1ccccc1C(C)OC
InChIInChI=1S/C10H13NO/c1-8(12-2)10-6-4-3-5-9(10)7-11/h3-8,11H,1-2H3/b11-7+
InChIKeyUHQSCGRNJYPFEA-YRNVUSSQSA-N
XLogP2.39
TPSA33.08 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(1-methoxyethyl)phenyl]methanimine?
The IUPAC name of [2-(1-methoxyethyl)phenyl]methanimine (CID 20711806) is [2-(1-methoxyethyl)phenyl]methanimine.
What is the SMILES notation for [2-(1-methoxyethyl)phenyl]methanimine?
The canonical SMILES for [2-(1-methoxyethyl)phenyl]methanimine is [H]/N=C/c1ccccc1C(C)OC.
What is the InChIKey of [2-(1-methoxyethyl)phenyl]methanimine?
The InChIKey is UHQSCGRNJYPFEA-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H13NO/c1-8(12-2)10-6-4-3-5-9(10)7-11/h3-8,11H,1-2H3/b11-7+.
What are the key properties of [2-(1-methoxyethyl)phenyl]methanimine?
[2-(1-methoxyethyl)phenyl]methanimine has a molecular weight of 163.22 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methoxyethyl)phenyl]methanimine is sourced from PubChem (CID 20711806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).