2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol

C11H10FN3O — CID 105473582

IUPAC2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol
SMILESOCCc1nncc(-c2ccccc2F)n1
InChIInChI=1S/C11H10FN3O/c12-9-4-2-1-3-8(9)10-7-13-15-11(14-10)5-6-16/h1-4,7,16H,5-6H2
InChIKeySPZBGFZOHOZUDC-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.21
Rot. Bonds3

About 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol

2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol (PubChem CID 105473582) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol.

Molecular Properties

Compound Name2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol
PubChem CID105473582
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol
SMILESOCCc1nncc(-c2ccccc2F)n1
InChIInChI=1S/C11H10FN3O/c12-9-4-2-1-3-8(9)10-7-13-15-11(14-10)5-6-16/h1-4,7,16H,5-6H2
InChIKeySPZBGFZOHOZUDC-UHFFFAOYSA-N
XLogP1.21
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(2-fluorophenyl)-2-pyridinyl]ethanol
CID 117001694
3-[5-(4-fluorophenyl)-1,2,4-triazin-3-yl]propan-1-ol
CID 105492376
6-(2-fluorophenyl)pyridazin-4-amine
CID 117127151
5-chloro-3-(2-fluorophenyl)pyridazine
CID 117107044
4-[3-(3-hydroxypropyl)-1,2,4-triazin-5-yl]phenol
CID 136699767
2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethanol
CID 115080371
5-(2-fluorophenyl)-2H-triazolo[4,5-b]pyrazine
CID 152521163
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-5-(2-fluorophenyl)-1,2,4-triazin-3-amine
CID 25453907
methyl (2S)-2-[[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]amino]-3-methylbutanoate
CID 25384153
5-(2-fluorophenyl)-N-methyl-N-(oxan-4-ylmethyl)-1,2,4-triazin-3-amine
CID 42557925
2-(5-cycloheptyl-1,2,4-triazin-3-yl)ethanol
CID 105477919
2-[2-(2-fluorophenyl)pyrimidin-5-yl]oxyethanol
CID 117230582

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol?
The IUPAC name of 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol (CID 105473582) is 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol.
What is the SMILES notation for 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol?
The canonical SMILES for 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol is OCCc1nncc(-c2ccccc2F)n1.
What is the InChIKey of 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol?
The InChIKey is SPZBGFZOHOZUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c12-9-4-2-1-3-8(9)10-7-13-15-11(14-10)5-6-16/h1-4,7,16H,5-6H2.
What are the key properties of 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol?
2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol has a molecular weight of 219.22 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-fluorophenyl)-1,2,4-triazin-3-yl]ethanol is sourced from PubChem (CID 105473582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).