1-methyl-2-(3-methylphenoxy)imidazole

C11H12N2O — CID 117189440

IUPAC1-methyl-2-(3-methylphenoxy)imidazole
SMILESCc1cccc(Oc2nccn2C)c1
InChIInChI=1S/C11H12N2O/c1-9-4-3-5-10(8-9)14-11-12-6-7-13(11)2/h3-8H,1-2H3
InChIKeyAQDBJRWSWJLAID-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.52
Rot. Bonds2

About 1-methyl-2-(3-methylphenoxy)imidazole

1-methyl-2-(3-methylphenoxy)imidazole (PubChem CID 117189440) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-methyl-2-(3-methylphenoxy)imidazole.

Molecular Properties

Compound Name1-methyl-2-(3-methylphenoxy)imidazole
PubChem CID117189440
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name1-methyl-2-(3-methylphenoxy)imidazole
SMILESCc1cccc(Oc2nccn2C)c1
InChIInChI=1S/C11H12N2O/c1-9-4-3-5-10(8-9)14-11-12-6-7-13(11)2/h3-8H,1-2H3
InChIKeyAQDBJRWSWJLAID-UHFFFAOYSA-N
XLogP2.52
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(3-methylphenoxy)imidazole?
The IUPAC name of 1-methyl-2-(3-methylphenoxy)imidazole (CID 117189440) is 1-methyl-2-(3-methylphenoxy)imidazole.
What is the SMILES notation for 1-methyl-2-(3-methylphenoxy)imidazole?
The canonical SMILES for 1-methyl-2-(3-methylphenoxy)imidazole is Cc1cccc(Oc2nccn2C)c1.
What is the InChIKey of 1-methyl-2-(3-methylphenoxy)imidazole?
The InChIKey is AQDBJRWSWJLAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-9-4-3-5-10(8-9)14-11-12-6-7-13(11)2/h3-8H,1-2H3.
What are the key properties of 1-methyl-2-(3-methylphenoxy)imidazole?
1-methyl-2-(3-methylphenoxy)imidazole has a molecular weight of 188.23 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(3-methylphenoxy)imidazole is sourced from PubChem (CID 117189440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).