1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol

C10H16N2O2 — CID 141337772

IUPAC1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol
SMILESCc1nc(C(C)O)c(C)nc1C(C)O
InChIInChI=1S/C10H16N2O2/c1-5-9(7(3)13)12-6(2)10(11-5)8(4)14/h7-8,13-14H,1-4H3
InChIKeyQMHLLLQTQQSBCO-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.20
Rot. Bonds2

About 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol

1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol (PubChem CID 141337772) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol.

Molecular Properties

Compound Name1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol
PubChem CID141337772
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol
SMILESCc1nc(C(C)O)c(C)nc1C(C)O
InChIInChI=1S/C10H16N2O2/c1-5-9(7(3)13)12-6(2)10(11-5)8(4)14/h7-8,13-14H,1-4H3
InChIKeyQMHLLLQTQQSBCO-UHFFFAOYSA-N
XLogP1.20
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol?
The IUPAC name of 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol (CID 141337772) is 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol.
What is the SMILES notation for 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol?
The canonical SMILES for 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol is Cc1nc(C(C)O)c(C)nc1C(C)O.
What is the InChIKey of 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol?
The InChIKey is QMHLLLQTQQSBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-5-9(7(3)13)12-6(2)10(11-5)8(4)14/h7-8,13-14H,1-4H3.
What are the key properties of 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol?
1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol has a molecular weight of 196.25 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1-hydroxyethyl)-3,6-dimethylpyrazin-2-yl]ethanol is sourced from PubChem (CID 141337772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).