[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol

C13H9F4NO — CID 133089786

IUPAC[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
SMILESOCc1ccc(-c2ccc(C(F)(F)F)cc2)c(F)n1
InChIInChI=1S/C13H9F4NO/c14-12-11(6-5-10(7-19)18-12)8-1-3-9(4-2-8)13(15,16)17/h1-6,19H,7H2
InChIKeyRYWYTECPGLZDPT-UHFFFAOYSA-N
MW271.21 g/mol
LogP3.40
Rot. Bonds2

About [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol

[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol (PubChem CID 133089786) has the molecular formula C13H9F4NO and a molecular weight of 271.21 g/mol. Its IUPAC name is [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
PubChem CID133089786
Molecular FormulaC13H9F4NO
Molecular Weight271.21 g/mol
Exact Mass271.06
IUPAC Name[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
SMILESOCc1ccc(-c2ccc(C(F)(F)F)cc2)c(F)n1
InChIInChI=1S/C13H9F4NO/c14-12-11(6-5-10(7-19)18-12)8-1-3-9(4-2-8)13(15,16)17/h1-6,19H,7H2
InChIKeyRYWYTECPGLZDPT-UHFFFAOYSA-N
XLogP3.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.21
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]acetic acid
CID 133089720
6-fluoro-5-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 133089695
[5-chloro-6-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
CID 134625763
[2-fluoro-5-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
CID 133089792
[6-[4-[4-(trifluoromethyl)phenoxy]phenyl]-2-pyridinyl]methanol
CID 66806394
2-[6-fluoro-5-[3-(trifluoromethyl)phenyl]-2-pyridinyl]acetonitrile
CID 133089736
[5-chloro-6-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
CID 134625740
2-[2-fluoro-5-[4-(trifluoromethyl)phenyl]-4-pyridinyl]acetic acid
CID 133089726
2-[3,6-bis[4-(trifluoromethyl)phenyl]-2-pyridinyl]acetic acid
CID 134623890
2-[2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]ethanol
CID 141113158
2-[5-fluoro-2-[4-(trifluoromethyl)phenyl]phenyl]acetic acid
CID 11630778
2-[4-(trifluoromethyl)phenyl]phenol
CID 11230142

Frequently Asked Questions

What is the IUPAC name of [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The IUPAC name of [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol (CID 133089786) is [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol.
What is the SMILES notation for [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The canonical SMILES for [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol is OCc1ccc(-c2ccc(C(F)(F)F)cc2)c(F)n1.
What is the InChIKey of [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
The InChIKey is RYWYTECPGLZDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F4NO/c14-12-11(6-5-10(7-19)18-12)8-1-3-9(4-2-8)13(15,16)17/h1-6,19H,7H2.
What are the key properties of [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol?
[6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol has a molecular weight of 271.21 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-fluoro-5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]methanol is sourced from PubChem (CID 133089786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).