2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol

C8H10F2N2O — CID 84661356

IUPAC2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol
SMILESCC(C)(O)c1cnc(C(F)F)cn1
InChIInChI=1S/C8H10F2N2O/c1-8(2,13)6-4-11-5(3-12-6)7(9)10/h3-4,7,13H,1-2H3
InChIKeyHRRIPPPCJDSJHE-UHFFFAOYSA-N
MW188.18 g/mol
LogP1.64
Rot. Bonds2

About 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol

2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol (PubChem CID 84661356) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol
PubChem CID84661356
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol
SMILESCC(C)(O)c1cnc(C(F)F)cn1
InChIInChI=1S/C8H10F2N2O/c1-8(2,13)6-4-11-5(3-12-6)7(9)10/h3-4,7,13H,1-2H3
InChIKeyHRRIPPPCJDSJHE-UHFFFAOYSA-N
XLogP1.64
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol?
The IUPAC name of 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol (CID 84661356) is 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol.
What is the SMILES notation for 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol?
The canonical SMILES for 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol is CC(C)(O)c1cnc(C(F)F)cn1.
What is the InChIKey of 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol?
The InChIKey is HRRIPPPCJDSJHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c1-8(2,13)6-4-11-5(3-12-6)7(9)10/h3-4,7,13H,1-2H3.
What are the key properties of 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol?
2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol has a molecular weight of 188.18 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(difluoromethyl)pyrazin-2-yl]propan-2-ol is sourced from PubChem (CID 84661356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).