2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol

C13H17N3O — CID 104823019

IUPAC2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol
SMILESCCn1ccnc1CC(O)c1ccc(C)nc1
InChIInChI=1S/C13H17N3O/c1-3-16-7-6-14-13(16)8-12(17)11-5-4-10(2)15-9-11/h4-7,9,12,17H,3,8H2,1-2H3
InChIKeyZPSYCKZZLJPHTN-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.88
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol

2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol (PubChem CID 104823019) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol
PubChem CID104823019
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol
SMILESCCn1ccnc1CC(O)c1ccc(C)nc1
InChIInChI=1S/C13H17N3O/c1-3-16-7-6-14-13(16)8-12(17)11-5-4-10(2)15-9-11/h4-7,9,12,17H,3,8H2,1-2H3
InChIKeyZPSYCKZZLJPHTN-UHFFFAOYSA-N
XLogP1.88
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105112266
1-(4-cyclopropylphenyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79980251
2-(1-ethylimidazol-2-yl)-1-[4-(methoxymethyl)phenyl]ethanol
CID 79744333
1-(6-methyl-3-pyridinyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 105167771
2-(1-ethylimidazol-2-yl)-1-(5-fluoro-3-pyridinyl)ethanol
CID 105112405
2-(1-ethylimidazol-2-yl)-1-pyridin-2-ylethanol
CID 79743859
[1-(6-chloro-3-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105253214
1-(5-chlorothiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethanol
CID 79744784
2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
CID 79744158
2-(1-ethylimidazol-2-yl)-1-(2-iodophenyl)ethanol
CID 115819308
2-(1-ethylimidazol-2-yl)-1-(2-fluorophenyl)ethanol
CID 79744598
1-(6-methyl-3-pyridinyl)-2-pyridin-3-ylethanol
CID 63155414

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol (CID 104823019) is 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol is CCn1ccnc1CC(O)c1ccc(C)nc1.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol?
The InChIKey is ZPSYCKZZLJPHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-3-16-7-6-14-13(16)8-12(17)11-5-4-10(2)15-9-11/h4-7,9,12,17H,3,8H2,1-2H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol?
2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol has a molecular weight of 231.30 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-(6-methyl-3-pyridinyl)ethanol is sourced from PubChem (CID 104823019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).