(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol

C8H9N5O2 — CID 104515213

IUPAC(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol
SMILESCOc1nccnc1C(O)c1cn[nH]n1
InChIInChI=1S/C8H9N5O2/c1-15-8-6(9-2-3-10-8)7(14)5-4-11-13-12-5/h2-4,7,14H,1H3,(H,11,12,13)
InChIKeyZAECWEODPAADTK-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.31
Rot. Bonds3

About (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol

(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol (PubChem CID 104515213) has the molecular formula C8H9N5O2 and a molecular weight of 207.19 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol
PubChem CID104515213
Molecular FormulaC8H9N5O2
Molecular Weight207.19 g/mol
Exact Mass207.08
IUPAC Name(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol
SMILESCOc1nccnc1C(O)c1cn[nH]n1
InChIInChI=1S/C8H9N5O2/c1-15-8-6(9-2-3-10-8)7(14)5-4-11-13-12-5/h2-4,7,14H,1H3,(H,11,12,13)
InChIKeyZAECWEODPAADTK-UHFFFAOYSA-N
XLogP-0.31
TPSA96.81 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
CID 104514527
(1,5-dimethylpyrazol-4-yl)-(3-methoxypyrazin-2-yl)methanol
CID 113421458
4-(dimethoxymethyl)-2H-triazole
CID 134836838
(4-butoxyphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 105123968
(3,4-dimethoxyphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 104514494
3-(3-methoxypyrazin-2-yl)butanoic acid
CID 104516745
(2,5-dimethylphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 104514541
4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
CID 105123882
1-(3-methoxypyrazin-2-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105123869
2-(tert-butylamino)-1-(3-methoxypyrazin-2-yl)ethanol
CID 104516709
1-(3-methoxypyrazin-2-yl)-3,4,4-trimethylpentan-1-ol
CID 115831089
1-(3-methoxypyrazin-2-yl)-2-(2-methylpropylsulfanyl)ethanol
CID 104515130

Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol?
The IUPAC name of (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol (CID 104515213) is (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol is COc1nccnc1C(O)c1cn[nH]n1.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol?
The InChIKey is ZAECWEODPAADTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2/c1-15-8-6(9-2-3-10-8)7(14)5-4-11-13-12-5/h2-4,7,14H,1H3,(H,11,12,13).
What are the key properties of (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol?
(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol has a molecular weight of 207.19 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol is sourced from PubChem (CID 104515213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).