[4-(2-imidazol-1-ylethoxy)phenyl]methanol

C12H14N2O2 — CID 3063243

IUPAC[4-(2-imidazol-1-ylethoxy)phenyl]methanol
SMILESOCc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C12H14N2O2/c15-9-11-1-3-12(4-2-11)16-8-7-14-6-5-13-10-14/h1-6,10,15H,7-9H2
InChIKeyGDNYXDJGFLTMJN-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.45
Rot. Bonds5

About [4-(2-imidazol-1-ylethoxy)phenyl]methanol

[4-(2-imidazol-1-ylethoxy)phenyl]methanol (PubChem CID 3063243) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is [4-(2-imidazol-1-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[4-(2-imidazol-1-ylethoxy)phenyl]methanol
PubChem CID3063243
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name[4-(2-imidazol-1-ylethoxy)phenyl]methanol
SMILESOCc1ccc(OCCn2ccnc2)cc1
InChIInChI=1S/C12H14N2O2/c15-9-11-1-3-12(4-2-11)16-8-7-14-6-5-13-10-14/h1-6,10,15H,7-9H2
InChIKeyGDNYXDJGFLTMJN-UHFFFAOYSA-N
XLogP1.45
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Dazoxiben Hydrochloride
CID 53000
Dazoxiben
CID 53001
Skf 96365
CID 104955
1H-Imidazole, 1-(2-phenoxyethyl)-
CID 13569172
SKF-96365 free base
CID 104956
(2-methoxyphenyl)(1-methyl-1H-imidazol-2-yl)methanol
CID 2870390
1-[2-(4-ethylphenoxy)ethyl]-1H-imidazole
CID 867238
1-[2-(2-methylphenoxy)ethyl]-1H-imidazole
CID 868346
1-[2-(4-Methoxyphenoxy)ethyl]imidazole
CID 868397
1-[5-(4-Ethylphenoxy)pentyl]imidazole
CID 2852313
Imidazole, 1-[2-(2,4,6-trimethylphenoxy)ethyl]-
CID 565898
2H-1-Benzopyran-2-one, 4-(2-(1H-imidazol-1-yl)ethoxy)-
CID 11311402

Frequently Asked Questions

What is the IUPAC name of [4-(2-imidazol-1-ylethoxy)phenyl]methanol?
The IUPAC name of [4-(2-imidazol-1-ylethoxy)phenyl]methanol (CID 3063243) is [4-(2-imidazol-1-ylethoxy)phenyl]methanol.
What is the SMILES notation for [4-(2-imidazol-1-ylethoxy)phenyl]methanol?
The canonical SMILES for [4-(2-imidazol-1-ylethoxy)phenyl]methanol is OCc1ccc(OCCn2ccnc2)cc1.
What is the InChIKey of [4-(2-imidazol-1-ylethoxy)phenyl]methanol?
The InChIKey is GDNYXDJGFLTMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c15-9-11-1-3-12(4-2-11)16-8-7-14-6-5-13-10-14/h1-6,10,15H,7-9H2.
What are the key properties of [4-(2-imidazol-1-ylethoxy)phenyl]methanol?
[4-(2-imidazol-1-ylethoxy)phenyl]methanol has a molecular weight of 218.26 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-imidazol-1-ylethoxy)phenyl]methanol is sourced from PubChem (CID 3063243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).