1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol

C14H16N2O2 — CID 113421532

IUPAC1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol
SMILESCOc1nccnc1C(O)Cc1cccc(C)c1
InChIInChI=1S/C14H16N2O2/c1-10-4-3-5-11(8-10)9-12(17)13-14(18-2)16-7-6-15-13/h3-8,12,17H,9H2,1-2H3
InChIKeyYNXPUAVXEFXZAO-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.07
Rot. Bonds4

About 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol

1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol (PubChem CID 113421532) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol
PubChem CID113421532
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol
SMILESCOc1nccnc1C(O)Cc1cccc(C)c1
InChIInChI=1S/C14H16N2O2/c1-10-4-3-5-11(8-10)9-12(17)13-14(18-2)16-7-6-15-13/h3-8,12,17H,9H2,1-2H3
InChIKeyYNXPUAVXEFXZAO-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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Related Compounds

1-(3-methoxypyrazin-2-yl)-3-(3-methylphenyl)propan-1-ol
CID 105124030
1-(3-methoxy-2-pyridinyl)-2-(3-methylphenyl)ethanol
CID 114053750
1-(3-methoxypyrazin-2-yl)-2-pyridin-2-ylethanol
CID 104515074
1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanol
CID 60798818
2-(3-fluorophenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
CID 113421578
2-(3-methylphenyl)-1-(2-methyl-4-pyridinyl)ethanol
CID 106756085
N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine
CID 104515368
4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
CID 105123882
(2,5-dimethylphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 104514541
1-(3-methoxypyrazin-2-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105123898
2-(3-methylphenyl)-1-(5-methyl-2-pyridinyl)ethanol
CID 81318745
1-(1-methylimidazol-2-yl)-2-(3-methylphenyl)ethanol
CID 63976645

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol (CID 113421532) is 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol is COc1nccnc1C(O)Cc1cccc(C)c1.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol?
The InChIKey is YNXPUAVXEFXZAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-4-3-5-11(8-10)9-12(17)13-14(18-2)16-7-6-15-13/h3-8,12,17H,9H2,1-2H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol?
1-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)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-(3-methoxypyrazin-2-yl)-2-(3-methylphenyl)ethanol is sourced from PubChem (CID 113421532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).