[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol

C11H10F3N3O — CID 140612636

IUPAC[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol
SMILESOCc1cccnc1-c1ccnn1C(F)(F)CF
InChIInChI=1S/C11H10F3N3O/c12-7-11(13,14)17-9(3-5-16-17)10-8(6-18)2-1-4-15-10/h1-5,18H,6-7H2
InChIKeyQYVSVFKCWIOGJY-UHFFFAOYSA-N
MW257.21 g/mol
LogP1.96
Rot. Bonds4

About [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol

[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol (PubChem CID 140612636) has the molecular formula C11H10F3N3O and a molecular weight of 257.21 g/mol. Its IUPAC name is [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol
PubChem CID140612636
Molecular FormulaC11H10F3N3O
Molecular Weight257.21 g/mol
Exact Mass257.08
IUPAC Name[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol
SMILESOCc1cccnc1-c1ccnn1C(F)(F)CF
InChIInChI=1S/C11H10F3N3O/c12-7-11(13,14)17-9(3-5-16-17)10-8(6-18)2-1-4-15-10/h1-5,18H,6-7H2
InChIKeyQYVSVFKCWIOGJY-UHFFFAOYSA-N
XLogP1.96
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.21
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-1,1,1-trifluoro-2-[5-(3-methylindazol-1-yl)pyridin-3-yl]propan-2-ol
CID 90252850
(2S)-1,1,1-trifluoro-2-[5-[3-(trifluoromethyl)indazol-1-yl]pyridin-3-yl]propan-2-ol
CID 90252851
(2R)-1,1,1-trifluoro-2-[5-(3-methylindazol-1-yl)pyridin-3-yl]propan-2-ol
CID 90252852
1,1,1-Trifluoro-2-[5-(5-fluoroindazol-1-yl)pyridin-3-yl]propan-2-ol
CID 90252864
2-[5-[3-(Trifluoromethyl)indazol-1-yl]pyridin-3-yl]propan-2-ol
CID 90252957
(4-(1H-Pyrazol-1-yl)phenyl)methanol
CID 2776480
[4-[3-(4-Fluorophenyl)-1-methylpyrazol-4-yl]-2-pyridinyl]methanol
CID 73293373
8-(2-Methyl-5-trifluoromethyl-2H-pyrazol-3-yl)-3,4-dihydro-1H-pyrano[4,3-c]pyridin-4-ol, Enantiomer II
CID 121389408
(3-(pyridin-4-yl)-1H-pyrazol-5-yl)methanol
CID 29922283
(1-Phenyl-3-pyridin-3-yl-1H-pyrazol-4-yl)-methanol
CID 740179
1-[1-[Methyl(pyridin-4-yl)amino]pyrrol-3-yl]ethanol
CID 10656402
3-(1H-Pyrazol-1-yl)benzyl alcohol
CID 7164580

Frequently Asked Questions

What is the IUPAC name of [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol?
The IUPAC name of [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol (CID 140612636) is [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol?
The canonical SMILES for [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol is OCc1cccnc1-c1ccnn1C(F)(F)CF.
What is the InChIKey of [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol?
The InChIKey is QYVSVFKCWIOGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3O/c12-7-11(13,14)17-9(3-5-16-17)10-8(6-18)2-1-4-15-10/h1-5,18H,6-7H2.
What are the key properties of [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol?
[2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol has a molecular weight of 257.21 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(1,1,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methanol is sourced from PubChem (CID 140612636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).