2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole

C12H16N2O — CID 110540743

IUPAC2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole
SMILESCCOc1ccc(C2=NCCN2C)cc1
InChIInChI=1S/C12H16N2O/c1-3-15-11-6-4-10(5-7-11)12-13-8-9-14(12)2/h4-7H,3,8-9H2,1-2H3
InChIKeyOFFGVJFZVRNAJE-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.78
Rot. Bonds3

About 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole

2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole (PubChem CID 110540743) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole
PubChem CID110540743
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole
SMILESCCOc1ccc(C2=NCCN2C)cc1
InChIInChI=1S/C12H16N2O/c1-3-15-11-6-4-10(5-7-11)12-13-8-9-14(12)2/h4-7H,3,8-9H2,1-2H3
InChIKeyOFFGVJFZVRNAJE-UHFFFAOYSA-N
XLogP1.78
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-diethoxyphenyl)-1-methyl-4,5-dihydroimidazole
CID 110540242
N-[(4-ethoxyphenyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969673
1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole
CID 110540583
1-N-ethenyl-1-N,2-N-dimethyl-2-N-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]benzene-1,2-diamine
CID 167056460
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
6-(4-ethoxyphenyl)-1,3-dimethylpyridin-2-one
CID 149000384
5-(4-ethoxyphenyl)-3-methylimidazol-4-amine
CID 62018469
6-(4-ethoxyphenyl)-2-methylpyridazin-3-one
CID 7660164
1-(4-ethoxyphenyl)-4-methylpiperazine-2,3-dione
CID 117026421
2-[4-[[4-(1,3-diethoxypropan-2-yloxy)phenyl]methyl]phenyl]-4,5-dihydroimidazol-1-amine
CID 69146590
5-(4-ethoxyphenyl)-2-methyl-1,3-oxazole
CID 166610196
2,5-bis(4-ethoxyphenyl)thiophene
CID 154402016

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole?
The IUPAC name of 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole (CID 110540743) is 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole.
What is the SMILES notation for 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole?
The canonical SMILES for 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole is CCOc1ccc(C2=NCCN2C)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole?
The InChIKey is OFFGVJFZVRNAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-3-15-11-6-4-10(5-7-11)12-13-8-9-14(12)2/h4-7H,3,8-9H2,1-2H3.
What are the key properties of 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole?
2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole has a molecular weight of 204.27 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole is sourced from PubChem (CID 110540743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).