(3,5,6-trimethylpyrazin-2-yl)methanol

C8H12N2O — CID 12629702

IUPAC(3,5,6-trimethylpyrazin-2-yl)methanol
SMILESCc1nc(C)c(CO)nc1C
InChIInChI=1S/C8H12N2O/c1-5-6(2)10-8(4-11)7(3)9-5/h11H,4H2,1-3H3
InChIKeyLAXOCXPBJXIBHO-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.89
Rot. Bonds1

About (3,5,6-trimethylpyrazin-2-yl)methanol

(3,5,6-trimethylpyrazin-2-yl)methanol (PubChem CID 12629702) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is (3,5,6-trimethylpyrazin-2-yl)methanol.

Molecular Properties

Compound Name(3,5,6-trimethylpyrazin-2-yl)methanol
PubChem CID12629702
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name(3,5,6-trimethylpyrazin-2-yl)methanol
SMILESCc1nc(C)c(CO)nc1C
InChIInChI=1S/C8H12N2O/c1-5-6(2)10-8(4-11)7(3)9-5/h11H,4H2,1-3H3
InChIKeyLAXOCXPBJXIBHO-UHFFFAOYSA-N
XLogP0.89
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3,5,6-trimethylpyrazin-2-yl)methanol?
The IUPAC name of (3,5,6-trimethylpyrazin-2-yl)methanol (CID 12629702) is (3,5,6-trimethylpyrazin-2-yl)methanol.
What is the SMILES notation for (3,5,6-trimethylpyrazin-2-yl)methanol?
The canonical SMILES for (3,5,6-trimethylpyrazin-2-yl)methanol is Cc1nc(C)c(CO)nc1C.
What is the InChIKey of (3,5,6-trimethylpyrazin-2-yl)methanol?
The InChIKey is LAXOCXPBJXIBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-5-6(2)10-8(4-11)7(3)9-5/h11H,4H2,1-3H3.
What are the key properties of (3,5,6-trimethylpyrazin-2-yl)methanol?
(3,5,6-trimethylpyrazin-2-yl)methanol has a molecular weight of 152.20 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5,6-trimethylpyrazin-2-yl)methanol is sourced from PubChem (CID 12629702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).