2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol

C11H16N4O — CID 79744158

IUPAC2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
SMILESCCn1ccnc1CC(O)c1cncn1C
InChIInChI=1S/C11H16N4O/c1-3-15-5-4-13-11(15)6-10(16)9-7-12-8-14(9)2/h4-5,7-8,10,16H,3,6H2,1-2H3
InChIKeyVVEVHDMMTVHNIG-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.91
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol

2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol (PubChem CID 79744158) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
PubChem CID79744158
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
SMILESCCn1ccnc1CC(O)c1cncn1C
InChIInChI=1S/C11H16N4O/c1-3-15-5-4-13-11(15)6-10(16)9-7-12-8-14(9)2/h4-5,7-8,10,16H,3,6H2,1-2H3
InChIKeyVVEVHDMMTVHNIG-UHFFFAOYSA-N
XLogP0.91
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-cyclopropylimidazol-4-yl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79744805
(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 66117982
1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 82903281
2-(1-ethylimidazol-2-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105112266
2-(1-ethylimidazol-2-yl)-1-(5-fluoro-3-pyridinyl)ethanol
CID 105112405
3-(1-ethylimidazol-2-yl)-2-hydroxypropanoic acid
CID 79744530
2-(1-ethylpyrazol-4-yl)-1-(3-methylimidazol-4-yl)ethanol
CID 66116928
2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol
CID 104823019
1-(5-chlorothiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79744784
N-[(1-ethylimidazol-2-yl)-(3-methylimidazol-4-yl)methyl]ethanamine
CID 82903316
1-(3-methylimidazol-4-yl)-2-phenylethanol
CID 66118824
2-(1-ethylimidazol-2-yl)-1-pyridin-2-ylethanol
CID 79743859

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol (CID 79744158) is 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol is CCn1ccnc1CC(O)c1cncn1C.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol?
The InChIKey is VVEVHDMMTVHNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-15-5-4-13-11(15)6-10(16)9-7-12-8-14(9)2/h4-5,7-8,10,16H,3,6H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol has a molecular weight of 220.28 g/mol, XLogP of 0.91, 4 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-methylimidazol-4-yl)ethanol is sourced from PubChem (CID 79744158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).