2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol

C13H17N3O2 — CID 105066362

IUPAC2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol
SMILESCCn1ccnc1CC(O)c1ccncc1OC
InChIInChI=1S/C13H17N3O2/c1-3-16-7-6-15-13(16)8-11(17)10-4-5-14-9-12(10)18-2/h4-7,9,11,17H,3,8H2,1-2H3
InChIKeyHRGWYKBCWASXAE-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.58
Rot. Bonds5

About 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol

2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol (PubChem CID 105066362) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol
PubChem CID105066362
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol
SMILESCCn1ccnc1CC(O)c1ccncc1OC
InChIInChI=1S/C13H17N3O2/c1-3-16-7-6-15-13(16)8-11(17)10-4-5-14-9-12(10)18-2/h4-7,9,11,17H,3,8H2,1-2H3
InChIKeyHRGWYKBCWASXAE-UHFFFAOYSA-N
XLogP1.58
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethyl]propan-1-amine
CID 105065826
2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 115819361
1-(3-methoxy-4-pyridinyl)-3-(1-methylimidazol-2-yl)propan-1-ol
CID 105066465
2-(4-ethylphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
CID 105066190
2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanone
CID 105065016
1-(4-bromo-2-methoxyphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821013
2-(1-ethylimidazol-2-yl)-1-(2-fluorophenyl)ethanol
CID 79744598
2-(1-ethylimidazol-2-yl)-1-(2-iodophenyl)ethanol
CID 115819308
1-(3-methoxy-4-pyridinyl)pentan-1-ol
CID 105066220
1-(3-methoxy-4-pyridinyl)-2-(1-methylbenzimidazol-2-yl)ethanol
CID 105066358
2-(1-ethylimidazol-2-yl)-1-[4-(methoxymethyl)phenyl]ethanol
CID 79744333
1-(2-tert-butylphenyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 115819265

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol (CID 105066362) is 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol is CCn1ccnc1CC(O)c1ccncc1OC.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol?
The InChIKey is HRGWYKBCWASXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-3-16-7-6-15-13(16)8-11(17)10-4-5-14-9-12(10)18-2/h4-7,9,11,17H,3,8H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol has a molecular weight of 247.30 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(3-methoxy-4-pyridinyl)ethanol is sourced from PubChem (CID 105066362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).