1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol

C14H16N2O2 — CID 572755

IUPAC1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol
SMILESCOc1ccc(C(O)Cc2cncc(C)n2)cc1
InChIInChI=1S/C14H16N2O2/c1-10-8-15-9-12(16-10)7-14(17)11-3-5-13(18-2)6-4-11/h3-6,8-9,14,17H,7H2,1-2H3
InChIKeySTDLYLSHGWXBQA-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.07
Rot. Bonds4

About 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol

1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol (PubChem CID 572755) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol
PubChem CID572755
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol
SMILESCOc1ccc(C(O)Cc2cncc(C)n2)cc1
InChIInChI=1S/C14H16N2O2/c1-10-8-15-9-12(16-10)7-14(17)11-3-5-13(18-2)6-4-11/h3-6,8-9,14,17H,7H2,1-2H3
InChIKeySTDLYLSHGWXBQA-UHFFFAOYSA-N
XLogP2.07
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol?
The IUPAC name of 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol (CID 572755) is 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol is COc1ccc(C(O)Cc2cncc(C)n2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol?
The InChIKey is STDLYLSHGWXBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-8-15-9-12(16-10)7-14(17)11-3-5-13(18-2)6-4-11/h3-6,8-9,14,17H,7H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol?
1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol has a molecular weight of 244.29 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(6-methylpyrazin-2-yl)ethanol is sourced from PubChem (CID 572755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).