1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole

C17H24N2O2 — CID 140978463

IUPAC1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole
SMILESCCn1cc(C(C)C)nc1COCc1ccc(OC)cc1
InChIInChI=1S/C17H24N2O2/c1-5-19-10-16(13(2)3)18-17(19)12-21-11-14-6-8-15(20-4)9-7-14/h6-10,13H,5,11-12H2,1-4H3
InChIKeyUBGPWXCRCSBTOK-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.75
Rot. Bonds7

About 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole

1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole (PubChem CID 140978463) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole.

Molecular Properties

Compound Name1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole
PubChem CID140978463
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole
SMILESCCn1cc(C(C)C)nc1COCc1ccc(OC)cc1
InChIInChI=1S/C17H24N2O2/c1-5-19-10-16(13(2)3)18-17(19)12-21-11-14-6-8-15(20-4)9-7-14/h6-10,13H,5,11-12H2,1-4H3
InChIKeyUBGPWXCRCSBTOK-UHFFFAOYSA-N
XLogP3.75
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(ethylsulfanylmethoxymethyl)-4-methoxybenzene
CID 101098323
5-(3,5-dichlorophenyl)sulfanyl-2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-4-propan-2-ylimidazole
CID 22130548
3-bromo-2-fluoro-5-[(4-methoxyphenyl)methoxymethyl]pyridine
CID 59548291
1-methoxy-4-[[(E)-4-[(4-methoxyphenyl)methoxy]but-2-enoxy]methyl]benzene
CID 14814212
1-[(4-methoxyphenyl)methoxy]-2-methylpentan-3-one
CID 58822506
1-methoxy-4-[[(2R)-2-methylpent-3-enoxy]methyl]benzene
CID 71377965
1-fluoro-2-[(4-methoxyphenyl)methoxymethyl]benzene
CID 145304623
1-[(4-methoxyphenyl)methyl]-3-propan-2-ylpyrazole-5-carboxylic acid
CID 82306829
(E,2R,5S)-1-[(4-methoxyphenyl)methoxy]-5-methylhept-3-en-2-ol
CID 10084181
1-(1-bromoethoxymethyl)-4-methoxybenzene
CID 56989997
1-methoxy-4-[2-(2-methoxyethoxy)ethoxymethyl]benzene
CID 102074732
N'-hydroxy-4-[(4-methoxyphenyl)methoxymethyl]benzenecarboximidamide
CID 43196897

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole?
The IUPAC name of 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole (CID 140978463) is 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole.
What is the SMILES notation for 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole?
The canonical SMILES for 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole is CCn1cc(C(C)C)nc1COCc1ccc(OC)cc1.
What is the InChIKey of 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole?
The InChIKey is UBGPWXCRCSBTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-5-19-10-16(13(2)3)18-17(19)12-21-11-14-6-8-15(20-4)9-7-14/h6-10,13H,5,11-12H2,1-4H3.
What are the key properties of 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole?
1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole has a molecular weight of 288.39 g/mol, XLogP of 3.75, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[(4-methoxyphenyl)methoxymethyl]-4-propan-2-ylimidazole is sourced from PubChem (CID 140978463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).