1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol

C11H14N4O — CID 107046410

IUPAC1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol
SMILESCc1ccc(C(O)Cc2cn(C)nn2)cn1
InChIInChI=1S/C11H14N4O/c1-8-3-4-9(6-12-8)11(16)5-10-7-15(2)14-13-10/h3-4,6-7,11,16H,5H2,1-2H3
InChIKeyZLEPCUAYASGXAP-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.79
Rot. Bonds3

About 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol

1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol (PubChem CID 107046410) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol
PubChem CID107046410
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol
SMILESCc1ccc(C(O)Cc2cn(C)nn2)cn1
InChIInChI=1S/C11H14N4O/c1-8-3-4-9(6-12-8)11(16)5-10-7-15(2)14-13-10/h3-4,6-7,11,16H,5H2,1-2H3
InChIKeyZLEPCUAYASGXAP-UHFFFAOYSA-N
XLogP0.79
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-ethylpyrazol-4-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107046191
1-(4-cyclopropylphenyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107046180
1-(3,5-dimethoxyphenyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107045928
1-(5-methylfuran-2-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107045816
1-(5-iodothiophen-3-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107065610
1-(3-methylfuran-2-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107046440
1-(6-methyl-3-pyridinyl)-2-pyridin-3-ylethanol
CID 63155414
2-(1-methyltriazol-4-yl)-1-(1,3-thiazol-4-yl)ethanol
CID 107046422
1-(5-chloro-2-methylphenyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107065654
1-(2-bromo-3-methylphenyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107985909
1-(3-fluoro-4-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107048060
1-(5-ethylfuran-2-yl)-2-(1-methyltriazol-4-yl)ethanol
CID 107045958

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol?
The IUPAC name of 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol (CID 107046410) is 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol.
What is the SMILES notation for 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol?
The canonical SMILES for 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol is Cc1ccc(C(O)Cc2cn(C)nn2)cn1.
What is the InChIKey of 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol?
The InChIKey is ZLEPCUAYASGXAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-3-4-9(6-12-8)11(16)5-10-7-15(2)14-13-10/h3-4,6-7,11,16H,5H2,1-2H3.
What are the key properties of 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol?
1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol has a molecular weight of 218.26 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-3-pyridinyl)-2-(1-methyltriazol-4-yl)ethanol is sourced from PubChem (CID 107046410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).