1-(3-methoxypyrazin-2-yl)-1-phenylethanol

C13H14N2O2 — CID 113421421

IUPAC1-(3-methoxypyrazin-2-yl)-1-phenylethanol
SMILESCOc1nccnc1C(C)(O)c1ccccc1
InChIInChI=1S/C13H14N2O2/c1-13(16,10-6-4-3-5-7-10)11-12(17-2)15-9-8-14-11/h3-9,16H,1-2H3
InChIKeyHTEVIVXAJKWVDM-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.74
Rot. Bonds3

About 1-(3-methoxypyrazin-2-yl)-1-phenylethanol

1-(3-methoxypyrazin-2-yl)-1-phenylethanol (PubChem CID 113421421) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-1-phenylethanol.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-1-phenylethanol
PubChem CID113421421
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name1-(3-methoxypyrazin-2-yl)-1-phenylethanol
SMILESCOc1nccnc1C(C)(O)c1ccccc1
InChIInChI=1S/C13H14N2O2/c1-13(16,10-6-4-3-5-7-10)11-12(17-2)15-9-8-14-11/h3-9,16H,1-2H3
InChIKeyHTEVIVXAJKWVDM-UHFFFAOYSA-N
XLogP1.74
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-bromophenyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 113421425
1-(2-methoxyphenyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104514450
1-(3-methoxypyrazin-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 104514467
1-(5-fluoro-2-pyridinyl)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104514737
2-(3-methoxypyrazin-2-yl)-N-methylpropan-2-amine
CID 175976338
3-amino-1,1,1-trifluoro-2-(3-methoxypyrazin-2-yl)butan-2-ol
CID 113421686
2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 104516755
2-ethyl-1-(3-methoxypyrazin-2-yl)-2-phenylbutan-1-ol
CID 104515115
4-(3-methoxypyrazin-2-yl)-4-methylpentan-2-one
CID 104516378
1-(3-methoxyphenyl)-1-phenylethanol
CID 15680503
(1S)-1-(3-methoxyphenyl)-1-phenylethanol
CID 29415940
1-[2-(1-hydroxy-1-phenylethyl)phenyl]-1-phenylethanol
CID 139663259

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-1-phenylethanol?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-1-phenylethanol (CID 113421421) is 1-(3-methoxypyrazin-2-yl)-1-phenylethanol.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-1-phenylethanol?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-1-phenylethanol is COc1nccnc1C(C)(O)c1ccccc1.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-1-phenylethanol?
The InChIKey is HTEVIVXAJKWVDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-13(16,10-6-4-3-5-7-10)11-12(17-2)15-9-8-14-11/h3-9,16H,1-2H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-1-phenylethanol?
1-(3-methoxypyrazin-2-yl)-1-phenylethanol has a molecular weight of 230.27 g/mol, XLogP of 1.74, 3 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)-1-phenylethanol is sourced from PubChem (CID 113421421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).