1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol

C11H12N4O — CID 62769436

IUPAC1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol
SMILESCc1nc(-c2cnccn2)ncc1C(C)O
InChIInChI=1S/C11H12N4O/c1-7-9(8(2)16)5-14-11(15-7)10-6-12-3-4-13-10/h3-6,8,16H,1-2H3
InChIKeyOWUVSQOQQWEBOM-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.30
Rot. Bonds2

About 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol

1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol (PubChem CID 62769436) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol.

Molecular Properties

Compound Name1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol
PubChem CID62769436
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol
SMILESCc1nc(-c2cnccn2)ncc1C(C)O
InChIInChI=1S/C11H12N4O/c1-7-9(8(2)16)5-14-11(15-7)10-6-12-3-4-13-10/h3-6,8,16H,1-2H3
InChIKeyOWUVSQOQQWEBOM-UHFFFAOYSA-N
XLogP1.30
TPSA71.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol?
The IUPAC name of 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol (CID 62769436) is 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol.
What is the SMILES notation for 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol?
The canonical SMILES for 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol is Cc1nc(-c2cnccn2)ncc1C(C)O.
What is the InChIKey of 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol?
The InChIKey is OWUVSQOQQWEBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-7-9(8(2)16)5-14-11(15-7)10-6-12-3-4-13-10/h3-6,8,16H,1-2H3.
What are the key properties of 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol?
1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol has a molecular weight of 216.24 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-2-pyrazin-2-ylpyrimidin-5-yl)ethanol is sourced from PubChem (CID 62769436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).