[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol

C8H11F2N3O — CID 107372967

IUPAC[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol
SMILESCN(CC(F)F)c1cnc(CO)cn1
InChIInChI=1S/C8H11F2N3O/c1-13(4-7(9)10)8-3-11-6(5-14)2-12-8/h2-3,7,14H,4-5H2,1H3
InChIKeyBPSLAJLVKZWKTI-UHFFFAOYSA-N
MW203.19 g/mol
LogP0.67
Rot. Bonds4

About [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol

[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol (PubChem CID 107372967) has the molecular formula C8H11F2N3O and a molecular weight of 203.19 g/mol. Its IUPAC name is [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol
PubChem CID107372967
Molecular FormulaC8H11F2N3O
Molecular Weight203.19 g/mol
Exact Mass203.09
IUPAC Name[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol
SMILESCN(CC(F)F)c1cnc(CO)cn1
InChIInChI=1S/C8H11F2N3O/c1-13(4-7(9)10)8-3-11-6(5-14)2-12-8/h2-3,7,14H,4-5H2,1H3
InChIKeyBPSLAJLVKZWKTI-UHFFFAOYSA-N
XLogP0.67
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[5-(hydroxymethyl)pyrazin-2-yl]-methylamino]ethanol
CID 107372728
[5-[methyl(prop-2-ynyl)amino]pyrazin-2-yl]methanol
CID 107372927
[5-[methyl(2-pyridin-2-ylethyl)amino]pyrazin-2-yl]methanol
CID 107372677
[5-[methyl(2-pyrrolidin-1-ylethyl)amino]pyrazin-2-yl]methanol
CID 107372852
[5-[ethyl(propan-2-yl)amino]pyrazin-2-yl]methanol
CID 107372692
[5-[methyl-(4-methylcyclohexyl)amino]pyrazin-2-yl]methanol
CID 107372760
2-[[5-(aminomethyl)pyrazin-2-yl]-(2,2-difluoroethyl)amino]ethanol
CID 107478418
[5-[methyl-[(2-methylfuran-3-yl)methyl]amino]pyrazin-2-yl]methanol
CID 107372750
1-[(5-aminopyrazin-2-yl)-methylamino]propan-2-ol
CID 80652394
[5-[methyl(oxolan-2-ylmethyl)amino]pyrazin-2-yl]methanol
CID 107372756
[5-[methyl(4-methylsulfanylbutan-2-yl)amino]pyrazin-2-yl]methanol
CID 107372975
[5-[2-(dimethylamino)ethyl-propylamino]pyrazin-2-yl]methanol
CID 107372809

Frequently Asked Questions

What is the IUPAC name of [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol?
The IUPAC name of [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol (CID 107372967) is [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol.
What is the SMILES notation for [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol?
The canonical SMILES for [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol is CN(CC(F)F)c1cnc(CO)cn1.
What is the InChIKey of [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol?
The InChIKey is BPSLAJLVKZWKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3O/c1-13(4-7(9)10)8-3-11-6(5-14)2-12-8/h2-3,7,14H,4-5H2,1H3.
What are the key properties of [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol?
[5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol has a molecular weight of 203.19 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2,2-difluoroethyl(methyl)amino]pyrazin-2-yl]methanol is sourced from PubChem (CID 107372967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).