[5-(difluoromethyl)pyrazin-2-yl]methanol

C6H6F2N2O — CID 84651001

IUPAC[5-(difluoromethyl)pyrazin-2-yl]methanol
SMILESOCc1cnc(C(F)F)cn1
InChIInChI=1S/C6H6F2N2O/c7-6(8)5-2-9-4(3-11)1-10-5/h1-2,6,11H,3H2
InChIKeyKWXCNYTXVOTIAU-UHFFFAOYSA-N
MW160.12 g/mol
LogP0.91
Rot. Bonds2

About [5-(difluoromethyl)pyrazin-2-yl]methanol

[5-(difluoromethyl)pyrazin-2-yl]methanol (PubChem CID 84651001) has the molecular formula C6H6F2N2O and a molecular weight of 160.12 g/mol. Its IUPAC name is [5-(difluoromethyl)pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-(difluoromethyl)pyrazin-2-yl]methanol
PubChem CID84651001
Molecular FormulaC6H6F2N2O
Molecular Weight160.12 g/mol
Exact Mass160.04
IUPAC Name[5-(difluoromethyl)pyrazin-2-yl]methanol
SMILESOCc1cnc(C(F)F)cn1
InChIInChI=1S/C6H6F2N2O/c7-6(8)5-2-9-4(3-11)1-10-5/h1-2,6,11H,3H2
InChIKeyKWXCNYTXVOTIAU-UHFFFAOYSA-N
XLogP0.91
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.12
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-(difluoromethyl)pyrazin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-(difluoromethyl)pyrazin-2-yl]methanol?
The IUPAC name of [5-(difluoromethyl)pyrazin-2-yl]methanol (CID 84651001) is [5-(difluoromethyl)pyrazin-2-yl]methanol.
What is the SMILES notation for [5-(difluoromethyl)pyrazin-2-yl]methanol?
The canonical SMILES for [5-(difluoromethyl)pyrazin-2-yl]methanol is OCc1cnc(C(F)F)cn1.
What is the InChIKey of [5-(difluoromethyl)pyrazin-2-yl]methanol?
The InChIKey is KWXCNYTXVOTIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2O/c7-6(8)5-2-9-4(3-11)1-10-5/h1-2,6,11H,3H2.
What are the key properties of [5-(difluoromethyl)pyrazin-2-yl]methanol?
[5-(difluoromethyl)pyrazin-2-yl]methanol has a molecular weight of 160.12 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)pyrazin-2-yl]methanol is sourced from PubChem (CID 84651001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).