[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol

C13H15N3O — CID 66468650

IUPAC[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol
SMILESCc1ccccc1N(C)c1cncc(CO)n1
InChIInChI=1S/C13H15N3O/c1-10-5-3-4-6-12(10)16(2)13-8-14-7-11(9-17)15-13/h3-8,17H,9H2,1-2H3
InChIKeyZHWGDYSFFHPGHN-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.05
Rot. Bonds3

About [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol

[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol (PubChem CID 66468650) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol
PubChem CID66468650
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol
SMILESCc1ccccc1N(C)c1cncc(CO)n1
InChIInChI=1S/C13H15N3O/c1-10-5-3-4-6-12(10)16(2)13-8-14-7-11(9-17)15-13/h3-8,17H,9H2,1-2H3
InChIKeyZHWGDYSFFHPGHN-UHFFFAOYSA-N
XLogP2.05
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol?
The IUPAC name of [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol (CID 66468650) is [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol.
What is the SMILES notation for [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol?
The canonical SMILES for [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol is Cc1ccccc1N(C)c1cncc(CO)n1.
What is the InChIKey of [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol?
The InChIKey is ZHWGDYSFFHPGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10-5-3-4-6-12(10)16(2)13-8-14-7-11(9-17)15-13/h3-8,17H,9H2,1-2H3.
What are the key properties of [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol?
[6-(N,2-dimethylanilino)pyrazin-2-yl]methanol has a molecular weight of 229.28 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(N,2-dimethylanilino)pyrazin-2-yl]methanol is sourced from PubChem (CID 66468650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).