2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone

C15H18N2O2 — CID 61405021

IUPAC2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone
SMILESCCc1nccn1CC(=O)c1ccc(C)cc1OC
InChIInChI=1S/C15H18N2O2/c1-4-15-16-7-8-17(15)10-13(18)12-6-5-11(2)9-14(12)19-3/h5-9H,4,10H2,1-3H3
InChIKeyLPAGLXJSNSKLRI-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.65
Rot. Bonds5

About 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone

2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone (PubChem CID 61405021) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone
PubChem CID61405021
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone
SMILESCCc1nccn1CC(=O)c1ccc(C)cc1OC
InChIInChI=1S/C15H18N2O2/c1-4-15-16-7-8-17(15)10-13(18)12-6-5-11(2)9-14(12)19-3/h5-9H,4,10H2,1-3H3
InChIKeyLPAGLXJSNSKLRI-UHFFFAOYSA-N
XLogP2.65
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methoxy-4-methylphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 106790241
1-(2-methoxy-4-methylphenyl)-2-pyridin-2-ylsulfanylethanone
CID 43802368
1-(2-methoxy-4-methylphenyl)-2-(4-methylpiperazin-1-yl)ethanone
CID 43794429
2-(4-hydroxy-4-methylpiperidin-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone
CID 81103470
3-[2-(2-methoxy-4-methylphenyl)-2-oxoethyl]imidazolidine-2,4-dione
CID 60772891
1-(4-bromophenyl)-2-(2-ethylimidazol-1-yl)ethanone
CID 61405257
2-(2-ethylimidazol-1-yl)-1-(4-iodophenyl)ethanone
CID 61405166
1-(2-methoxy-4-methylphenyl)-2-thiomorpholin-4-ylethanone
CID 62050975
1-[2-(2-methoxy-4-methylphenyl)-2-oxoethyl]piperidine-2,6-dione
CID 62024881
2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanone
CID 105065016
2-(3,5-dimethylpiperidin-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone
CID 43794292
2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(2-methoxy-4-methylphenyl)ethanone
CID 106790359

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone?
The IUPAC name of 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone (CID 61405021) is 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone.
What is the SMILES notation for 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone?
The canonical SMILES for 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone is CCc1nccn1CC(=O)c1ccc(C)cc1OC.
What is the InChIKey of 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone?
The InChIKey is LPAGLXJSNSKLRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-4-15-16-7-8-17(15)10-13(18)12-6-5-11(2)9-14(12)19-3/h5-9H,4,10H2,1-3H3.
What are the key properties of 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone?
2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone has a molecular weight of 258.32 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazol-1-yl)-1-(2-methoxy-4-methylphenyl)ethanone is sourced from PubChem (CID 61405021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).