1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol

C10H10F6N2O3 — CID 103312622

IUPAC1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol
SMILESCOc1cnc(C(O)C(C(F)(F)F)C(F)(F)F)c(OC)n1
InChIInChI=1S/C10H10F6N2O3/c1-20-4-3-17-5(8(18-4)21-2)6(19)7(9(11,12)13)10(14,15)16/h3,6-7,19H,1-2H3
InChIKeyAINFMNUCMKSFDC-UHFFFAOYSA-N
MW320.19 g/mol
LogP2.27
Rot. Bonds4

About 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol

1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol (PubChem CID 103312622) has the molecular formula C10H10F6N2O3 and a molecular weight of 320.19 g/mol. Its IUPAC name is 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol.

Molecular Properties

Compound Name1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol
PubChem CID103312622
Molecular FormulaC10H10F6N2O3
Molecular Weight320.19 g/mol
Exact Mass320.06
IUPAC Name1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol
SMILESCOc1cnc(C(O)C(C(F)(F)F)C(F)(F)F)c(OC)n1
InChIInChI=1S/C10H10F6N2O3/c1-20-4-3-17-5(8(18-4)21-2)6(19)7(9(11,12)13)10(14,15)16/h3,6-7,19H,1-2H3
InChIKeyAINFMNUCMKSFDC-UHFFFAOYSA-N
XLogP2.27
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol with MolForge

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Related Compounds

2-(1-Hydroxy-2-methylpropyl)-3-methoxypyrazine
CID 587218
2-(1-Hydroxy-1-methylpropyl)-3-methoxypyrazine
CID 101731875
1-(5-Fluoro-3-methoxypyrazin-2-yl)hexan-1-ol
CID 11287622
[6-(4,4-Difluoropiperidin-3-yl)-3-methoxypyrazin-2-yl]methanol
CID 176264646
1-(5-Fluoro-3-methoxypyrazin-2-yl)ethanol
CID 11816126
1-(3,5-Dimethoxypyrazin-2-yl)-3-(2,2,2-trifluoroethoxy)propan-1-ol
CID 103147418
3-(2,2-Difluoroethoxy)-1-(3,5-dimethoxypyrazin-2-yl)propan-1-ol
CID 103147696
3-(2,2-Difluoroethoxy)-1-(3-methoxypyrazin-2-yl)propan-1-ol
CID 103147900
3,3,3-Trifluoro-1-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)propan-1-ol
CID 103312623
1-(3,5-Dimethoxypyrazin-2-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanol
CID 103473932
1-(3,5-Dimethoxypyrazin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol
CID 104368409
1-(3,5-Dimethoxypyrazin-2-yl)-3-(trifluoromethyl)cyclohexan-1-ol
CID 104368410

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol?
The IUPAC name of 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol (CID 103312622) is 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol.
What is the SMILES notation for 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol?
The canonical SMILES for 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol is COc1cnc(C(O)C(C(F)(F)F)C(F)(F)F)c(OC)n1.
What is the InChIKey of 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol?
The InChIKey is AINFMNUCMKSFDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F6N2O3/c1-20-4-3-17-5(8(18-4)21-2)6(19)7(9(11,12)13)10(14,15)16/h3,6-7,19H,1-2H3.
What are the key properties of 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol?
1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol has a molecular weight of 320.19 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxypyrazin-2-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propan-1-ol is sourced from PubChem (CID 103312622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).