1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole

C21H24N2O — CID 86210837

IUPAC1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole
SMILESCOc1ccc(CCn2cc(C)nc2CCc2ccccc2)cc1
InChIInChI=1S/C21H24N2O/c1-17-16-23(15-14-19-8-11-20(24-2)12-9-19)21(22-17)13-10-18-6-4-3-5-7-18/h3-9,11-12,16H,10,13-15H2,1-2H3
InChIKeyMXQZWOLSVDNJKH-UHFFFAOYSA-N
MW320.44 g/mol
LogP4.23
Rot. Bonds7

About 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole

1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole (PubChem CID 86210837) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole
PubChem CID86210837
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC Name1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole
SMILESCOc1ccc(CCn2cc(C)nc2CCc2ccccc2)cc1
InChIInChI=1S/C21H24N2O/c1-17-16-23(15-14-19-8-11-20(24-2)12-9-19)21(22-17)13-10-18-6-4-3-5-7-18/h3-9,11-12,16H,10,13-15H2,1-2H3
InChIKeyMXQZWOLSVDNJKH-UHFFFAOYSA-N
XLogP4.23
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-4-(4-phenylbutyl)benzene
CID 15647797
1-methoxy-4-(6-phenylhexyl)benzene
CID 54077830
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CID 15505631
1-[2-(4-methoxyphenyl)ethyl]-3-methylpyrazole-4-carboxylic acid
CID 65446393
3-[2-(4-methoxyphenyl)ethyl]-1,4-dimethylpyrazole
CID 155131154
2-(4-methoxyphenyl)-N-[1-(2-phenylethyl)pyrazol-4-yl]acetamide
CID 95744739
1-benzyl-6-methoxy-2-(2-phenylethyl)benzimidazole
CID 134083782
(1-benzyl-4-methylimidazol-2-yl)methanamine
CID 130214981
2-[2-[2-(4-methoxyphenyl)ethyl]imidazol-1-yl]ethanol
CID 82560023
1-[2-(4-methoxyphenyl)ethyl]-2-methylindole
CID 65444625
2-(4-methoxyphenyl)-N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]acetamide
CID 46328909
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CID 17035993

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole?
The IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole (CID 86210837) is 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole?
The canonical SMILES for 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole is COc1ccc(CCn2cc(C)nc2CCc2ccccc2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole?
The InChIKey is MXQZWOLSVDNJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c1-17-16-23(15-14-19-8-11-20(24-2)12-9-19)21(22-17)13-10-18-6-4-3-5-7-18/h3-9,11-12,16H,10,13-15H2,1-2H3.
What are the key properties of 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole?
1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole has a molecular weight of 320.44 g/mol, XLogP of 4.23, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)ethyl]-4-methyl-2-(2-phenylethyl)imidazole is sourced from PubChem (CID 86210837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).