1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol

C9H10F4N2O2 — CID 103474101

IUPAC1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol
SMILESOC(COCC(F)(F)C(F)F)c1cnccn1
InChIInChI=1S/C9H10F4N2O2/c10-8(11)9(12,13)5-17-4-7(16)6-3-14-1-2-15-6/h1-3,7-8,16H,4-5H2
InChIKeyJHGVZJZMXBRBOP-UHFFFAOYSA-N
MW254.18 g/mol
LogP1.43
Rot. Bonds6

About 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol

1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol (PubChem CID 103474101) has the molecular formula C9H10F4N2O2 and a molecular weight of 254.18 g/mol. Its IUPAC name is 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol.

Molecular Properties

Compound Name1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol
PubChem CID103474101
Molecular FormulaC9H10F4N2O2
Molecular Weight254.18 g/mol
Exact Mass254.07
IUPAC Name1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol
SMILESOC(COCC(F)(F)C(F)F)c1cnccn1
InChIInChI=1S/C9H10F4N2O2/c10-8(11)9(12,13)5-17-4-7(16)6-3-14-1-2-15-6/h1-3,7-8,16H,4-5H2
InChIKeyJHGVZJZMXBRBOP-UHFFFAOYSA-N
XLogP1.43
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.18
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1-(Pyrazin-2-yl)ethane-1,2-diol
CID 14362260
1,1-Difluoro-2-[5-(hydroxymethyl)pyrazin-2-yl]propan-2-ol
CID 69608293
1-(6-(Trifluoromethyl)pyrazin-2-yl)ethan-1-ol
CID 164920760
1-[5-(Trifluoromethyl)pyrazin-2-yl]ethanol
CID 167221132
2,2,2-Trifluoro-1-(pyrazin-2-yl)ethanol
CID 63968803
4,4,4-Trifluoro-1-pyrazin-2-ylbutan-1-ol
CID 64566753
1-[6-(Difluoromethyl)pyrazin-2-yl]ethanol
CID 84654834
1-[5-(Difluoromethyl)pyrazin-2-yl]ethanol
CID 84654835
3-(2,2-Difluoroethoxy)-1-pyrazin-2-ylpropan-1-ol
CID 103147800
1-Pyrazin-2-yl-2-(2,2,2-trifluoroethoxy)ethanol
CID 103216825
1-(3-Methoxypyrazin-2-yl)-2-(2,2,2-trifluoroethoxy)ethanol
CID 103217071
1-(3-Methoxypyrazin-2-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanol
CID 103474004

Frequently Asked Questions

What is the IUPAC name of 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol?
The IUPAC name of 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol (CID 103474101) is 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol.
What is the SMILES notation for 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol?
The canonical SMILES for 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol is OC(COCC(F)(F)C(F)F)c1cnccn1.
What is the InChIKey of 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol?
The InChIKey is JHGVZJZMXBRBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F4N2O2/c10-8(11)9(12,13)5-17-4-7(16)6-3-14-1-2-15-6/h1-3,7-8,16H,4-5H2.
What are the key properties of 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol?
1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol has a molecular weight of 254.18 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazin-2-yl-2-(2,2,3,3-tetrafluoropropoxy)ethanol is sourced from PubChem (CID 103474101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).