2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole

C18H24N2O2 — CID 56876111

IUPAC2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole
SMILESCOc1c(C)cc(C)cc1-c1nccn1CC1CCCOC1
InChIInChI=1S/C18H24N2O2/c1-13-9-14(2)17(21-3)16(10-13)18-19-6-7-20(18)11-15-5-4-8-22-12-15/h6-7,9-10,15H,4-5,8,11-12H2,1-3H3
InChIKeyUGKLUAAIJWJEKX-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.60
Rot. Bonds4

About 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole

2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole (PubChem CID 56876111) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole.

Molecular Properties

Compound Name2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole
PubChem CID56876111
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole
SMILESCOc1c(C)cc(C)cc1-c1nccn1CC1CCCOC1
InChIInChI=1S/C18H24N2O2/c1-13-9-14(2)17(21-3)16(10-13)18-19-6-7-20(18)11-15-5-4-8-22-12-15/h6-7,9-10,15H,4-5,8,11-12H2,1-3H3
InChIKeyUGKLUAAIJWJEKX-UHFFFAOYSA-N
XLogP3.60
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole 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-(2,3-dimethoxy-5-methylphenyl)-1-(oxolan-2-ylmethyl)imidazole;formic acid
CID 171322062
4-[1-[[(3R)-oxan-3-yl]methyl]imidazol-2-yl]-2,1,3-benzoxadiazole
CID 95554101
4-[[(3S,4S)-4-[2-(2-methoxy-3,5-dimethylphenyl)imidazol-1-yl]oxolan-3-yl]methyl]pyridine
CID 170512463
2-(5-methylthiophen-2-yl)-1-(oxolan-3-ylmethyl)imidazole
CID 155912420
2-methoxy-5-[1-[2-(oxan-3-yl)ethyl]imidazol-2-yl]benzoic acid
CID 154570731
1-(cyclopentylmethyl)-2-(3,4-dimethoxyphenyl)imidazole
CID 165421175
2-[2-[2-(2,3-dimethoxy-5-methylphenyl)imidazol-1-yl]ethyl]-1-methylsulfonylpiperidine
CID 165420343
cis-(1R,3S)-3-[[2-(2-fluoro-5-methoxyphenyl)imidazol-1-yl]methyl]cyclohexan-1-amine
CID 154567236
3-methyl-1-(oxan-3-ylmethyl)pyrazole
CID 130610539
5,6-dimethyl-1-(oxolan-3-ylmethyl)benzimidazole
CID 115582514
1-(3-ethoxypropyl)-N-(oxan-3-ylmethyl)imidazol-2-amine
CID 106566033
3-[[2-(2,3-dimethoxy-5-methylphenyl)imidazol-1-yl]methyl]-4-methyl-1,2,5-oxadiazole
CID 165424669

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole?
The IUPAC name of 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole (CID 56876111) is 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole.
What is the SMILES notation for 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole?
The canonical SMILES for 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole is COc1c(C)cc(C)cc1-c1nccn1CC1CCCOC1.
What is the InChIKey of 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole?
The InChIKey is UGKLUAAIJWJEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-13-9-14(2)17(21-3)16(10-13)18-19-6-7-20(18)11-15-5-4-8-22-12-15/h6-7,9-10,15H,4-5,8,11-12H2,1-3H3.
What are the key properties of 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole?
2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole has a molecular weight of 300.40 g/mol, XLogP of 3.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3,5-dimethylphenyl)-1-(oxan-3-ylmethyl)imidazole is sourced from PubChem (CID 56876111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).