(3,6-diethyl-5-methylpyrazin-2-yl)methanol

C10H16N2O — CID 125486087

IUPAC(3,6-diethyl-5-methylpyrazin-2-yl)methanol
SMILESCCc1nc(CO)c(CC)nc1C
InChIInChI=1S/C10H16N2O/c1-4-8-7(3)11-9(5-2)10(6-13)12-8/h13H,4-6H2,1-3H3
InChIKeyTUJCXJYDEUXBPG-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.40
Rot. Bonds3

About (3,6-diethyl-5-methylpyrazin-2-yl)methanol

(3,6-diethyl-5-methylpyrazin-2-yl)methanol (PubChem CID 125486087) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is (3,6-diethyl-5-methylpyrazin-2-yl)methanol.

Molecular Properties

Compound Name(3,6-diethyl-5-methylpyrazin-2-yl)methanol
PubChem CID125486087
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name(3,6-diethyl-5-methylpyrazin-2-yl)methanol
SMILESCCc1nc(CO)c(CC)nc1C
InChIInChI=1S/C10H16N2O/c1-4-8-7(3)11-9(5-2)10(6-13)12-8/h13H,4-6H2,1-3H3
InChIKeyTUJCXJYDEUXBPG-UHFFFAOYSA-N
XLogP1.40
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3,6-diethyl-5-methylpyrazin-2-yl)methanol?
The IUPAC name of (3,6-diethyl-5-methylpyrazin-2-yl)methanol (CID 125486087) is (3,6-diethyl-5-methylpyrazin-2-yl)methanol.
What is the SMILES notation for (3,6-diethyl-5-methylpyrazin-2-yl)methanol?
The canonical SMILES for (3,6-diethyl-5-methylpyrazin-2-yl)methanol is CCc1nc(CO)c(CC)nc1C.
What is the InChIKey of (3,6-diethyl-5-methylpyrazin-2-yl)methanol?
The InChIKey is TUJCXJYDEUXBPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-4-8-7(3)11-9(5-2)10(6-13)12-8/h13H,4-6H2,1-3H3.
What are the key properties of (3,6-diethyl-5-methylpyrazin-2-yl)methanol?
(3,6-diethyl-5-methylpyrazin-2-yl)methanol has a molecular weight of 180.25 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-diethyl-5-methylpyrazin-2-yl)methanol is sourced from PubChem (CID 125486087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).