4-[2-(1-methylimidazol-2-yl)ethoxy]phenol

C12H14N2O2 — CID 114528497

IUPAC4-[2-(1-methylimidazol-2-yl)ethoxy]phenol
SMILESCn1ccnc1CCOc1ccc(O)cc1
InChIInChI=1S/C12H14N2O2/c1-14-8-7-13-12(14)6-9-16-11-4-2-10(15)3-5-11/h2-5,7-8,15H,6,9H2,1H3
InChIKeyJEYDOTHKUXVYLD-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.75
Rot. Bonds4

About 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol

4-[2-(1-methylimidazol-2-yl)ethoxy]phenol (PubChem CID 114528497) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol.

Molecular Properties

Compound Name4-[2-(1-methylimidazol-2-yl)ethoxy]phenol
PubChem CID114528497
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name4-[2-(1-methylimidazol-2-yl)ethoxy]phenol
SMILESCn1ccnc1CCOc1ccc(O)cc1
InChIInChI=1S/C12H14N2O2/c1-14-8-7-13-12(14)6-9-16-11-4-2-10(15)3-5-11/h2-5,7-8,15H,6,9H2,1H3
InChIKeyJEYDOTHKUXVYLD-UHFFFAOYSA-N
XLogP1.75
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]propan-2-amine
CID 114527270
3-[4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]prop-2-yn-1-amine
CID 114530874
N-[[4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]methyl]propan-1-amine
CID 114527116
(1R)-1-[2-fluoro-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 107720209
2-[2-(1-methylimidazol-2-yl)ethoxy]ethanol
CID 90045312
4-[4-[[4-[(1-methylimidazol-2-yl)methoxy]phenyl]methyl]piperazin-1-yl]phenol
CID 86998725
1-[5-[2-(1-methylimidazol-2-yl)ethoxy]-2-pyridinyl]propan-2-amine
CID 114530931
[5-methoxy-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]boronic acid
CID 114528534
6-[2-(1-methylimidazol-2-yl)ethoxy]-2,3-dihydro-1-benzofuran-3-amine
CID 114527225
4-[1-[2-(1-methylimidazol-2-yl)ethylamino]ethyl]phenol
CID 61214125
2-[2-[2-(bromomethyl)-5-propoxyphenoxy]ethyl]-1-methylimidazole
CID 114528438
4-[(1-methylimidazol-2-yl)methylamino]phenol
CID 62351704

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol?
The IUPAC name of 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol (CID 114528497) is 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol.
What is the SMILES notation for 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol?
The canonical SMILES for 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol is Cn1ccnc1CCOc1ccc(O)cc1.
What is the InChIKey of 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol?
The InChIKey is JEYDOTHKUXVYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-14-8-7-13-12(14)6-9-16-11-4-2-10(15)3-5-11/h2-5,7-8,15H,6,9H2,1H3.
What are the key properties of 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol?
4-[2-(1-methylimidazol-2-yl)ethoxy]phenol has a molecular weight of 218.26 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-methylimidazol-2-yl)ethoxy]phenol is sourced from PubChem (CID 114528497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).