2-(2-methoxyphenyl)-1-methylperimidine

C19H16N2O — CID 3047475

IUPAC2-(2-methoxyphenyl)-1-methylperimidine
SMILESCOc1ccccc1C1=Nc2cccc3cccc(c23)N1C
InChIInChI=1S/C19H16N2O/c1-21-16-11-6-8-13-7-5-10-15(18(13)16)20-19(21)14-9-3-4-12-17(14)22-2/h3-12H,1-2H3
InChIKeyWQHKWSLHTMSJAL-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.38
Rot. Bonds2

About 2-(2-methoxyphenyl)-1-methylperimidine

2-(2-methoxyphenyl)-1-methylperimidine (PubChem CID 3047475) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-methylperimidine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-methylperimidine
PubChem CID3047475
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name2-(2-methoxyphenyl)-1-methylperimidine
SMILESCOc1ccccc1C1=Nc2cccc3cccc(c23)N1C
InChIInChI=1S/C19H16N2O/c1-21-16-11-6-8-13-7-5-10-15(18(13)16)20-19(21)14-9-3-4-12-17(14)22-2/h3-12H,1-2H3
InChIKeyWQHKWSLHTMSJAL-UHFFFAOYSA-N
XLogP4.38
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'naphth_amino_A(25)', 'substructure': 'N/A'}

Analyze 2-(2-methoxyphenyl)-1-methylperimidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-methylperimidine?
The IUPAC name of 2-(2-methoxyphenyl)-1-methylperimidine (CID 3047475) is 2-(2-methoxyphenyl)-1-methylperimidine.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-methylperimidine?
The canonical SMILES for 2-(2-methoxyphenyl)-1-methylperimidine is COc1ccccc1C1=Nc2cccc3cccc(c23)N1C.
What is the InChIKey of 2-(2-methoxyphenyl)-1-methylperimidine?
The InChIKey is WQHKWSLHTMSJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-21-16-11-6-8-13-7-5-10-15(18(13)16)20-19(21)14-9-3-4-12-17(14)22-2/h3-12H,1-2H3.
What are the key properties of 2-(2-methoxyphenyl)-1-methylperimidine?
2-(2-methoxyphenyl)-1-methylperimidine has a molecular weight of 288.35 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-methylperimidine is sourced from PubChem (CID 3047475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).