1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol

C13H11F4NO — CID 90924135

IUPAC1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol
SMILESOC1C=CC(C(F)C(F)(F)F)=CN1c1ccccc1
InChIInChI=1S/C13H11F4NO/c14-12(13(15,16)17)9-6-7-11(19)18(8-9)10-4-2-1-3-5-10/h1-8,11-12,19H
InChIKeyWDNDHOZQTFTZTM-UHFFFAOYSA-N
MW273.23 g/mol
LogP3.17
Rot. Bonds2

About 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol

1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol (PubChem CID 90924135) has the molecular formula C13H11F4NO and a molecular weight of 273.23 g/mol. Its IUPAC name is 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol.

Molecular Properties

Compound Name1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol
PubChem CID90924135
Molecular FormulaC13H11F4NO
Molecular Weight273.23 g/mol
Exact Mass273.08
IUPAC Name1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol
SMILESOC1C=CC(C(F)C(F)(F)F)=CN1c1ccccc1
InChIInChI=1S/C13H11F4NO/c14-12(13(15,16)17)9-6-7-11(19)18(8-9)10-4-2-1-3-5-10/h1-8,11-12,19H
InChIKeyWDNDHOZQTFTZTM-UHFFFAOYSA-N
XLogP3.17
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.23
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol?
The IUPAC name of 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol (CID 90924135) is 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol.
What is the SMILES notation for 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol?
The canonical SMILES for 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol is OC1C=CC(C(F)C(F)(F)F)=CN1c1ccccc1.
What is the InChIKey of 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol?
The InChIKey is WDNDHOZQTFTZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F4NO/c14-12(13(15,16)17)9-6-7-11(19)18(8-9)10-4-2-1-3-5-10/h1-8,11-12,19H.
What are the key properties of 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol?
1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol has a molecular weight of 273.23 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-5-(1,2,2,2-tetrafluoroethyl)-2H-pyridin-2-ol is sourced from PubChem (CID 90924135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).