2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol

C17H11F2NO3 — CID 134158356

IUPAC2-fluoro-3-[6-(4-fluoro-3-hydroxyphenoxy)-2-pyridinyl]phenol
SMILESC1=CC(=C(C(=C1)O)F)C2=NC(=CC=C2)OC3=CC(=C(C=C3)F)O
InChIInChI=1S/C17H11F2NO3/c18-12-8-7-10(9-15(12)22)23-16-6-2-4-13(20-16)11-3-1-5-14(21)17(11)19/h1-9,21-22H
InChIKeyURNXTVXZHNOBRL-UHFFFAOYSA-N
MW315.27 g/mol
LogP3.90
Rot. Bonds3

About 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol

2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol (PubChem CID 134158356) has the molecular formula C17H11F2NO3 and a molecular weight of 315.27 g/mol. Its IUPAC name is 2-fluoro-3-[6-(4-fluoro-3-hydroxyphenoxy)-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol
PubChem CID134158356
Molecular FormulaC17H11F2NO3
Molecular Weight315.27 g/mol
Exact Mass315.07
IUPAC Name2-fluoro-3-[6-(4-fluoro-3-hydroxyphenoxy)-2-pyridinyl]phenol
SMILESC1=CC(=C(C(=C1)O)F)C2=NC(=CC=C2)OC3=CC(=C(C=C3)F)O
InChIInChI=1S/C17H11F2NO3/c18-12-8-7-10(9-15(12)22)23-16-6-2-4-13(20-16)11-3-1-5-14(21)17(11)19/h1-9,21-22H
InChIKeyURNXTVXZHNOBRL-UHFFFAOYSA-N
XLogP3.90
TPSA62.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity387

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.27
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-vinyl-6H-chromeno[4,3-b]quinoline-3,9-diol
CID 135438472
4-(3-Methoxy-5-methylphenoxy)-2-(4-methoxyphenyl)-6-methylpyridine
CID 71460891
3-[(2-Methyl-6-Phenylpyridin-4-Yl)oxy]phenol
CID 71462587
2-Fluoranyl-3-[6-[1-(4-fluoranyl-3-oxidanyl-phenyl)ethenyl]pyridin-2-yl]phenol
CID 134158354
2,6-Bis(3,4,5-trimethoxyphenyl)pyridine
CID 90670567
2-(3,4-Dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine
CID 90670575
2-(2,4-Dimethoxyphenyl)-6-(3-methoxyphenyl)pyridine
CID 90670587
5-[6-(2,4-Dimethoxyphenyl)-2-pyridinyl]-2-methoxyphenol
CID 90670590
5-[6-(2,4-Dimethoxyphenyl)-2-pyridinyl]-2-methoxyphenol;hydrochloride
CID 90670592
[2-(3-Phenoxyphenoxy)-6-(trifluoromethyl)pyridin-4-yl]methanamine
CID 122516838
2-Methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol
CID 136502284
2-[2-(3-hydroxyphenyl)-5H-chromeno[4,3-b]pyridin-4-yl]phenol
CID 137133390

Frequently Asked Questions

What is the IUPAC name of 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol?
The IUPAC name of 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol (CID 134158356) is 2-fluoro-3-[6-(4-fluoro-3-hydroxyphenoxy)-2-pyridinyl]phenol.
What is the SMILES notation for 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol?
The canonical SMILES for 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol is C1=CC(=C(C(=C1)O)F)C2=NC(=CC=C2)OC3=CC(=C(C=C3)F)O.
What is the InChIKey of 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol?
The InChIKey is URNXTVXZHNOBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F2NO3/c18-12-8-7-10(9-15(12)22)23-16-6-2-4-13(20-16)11-3-1-5-14(21)17(11)19/h1-9,21-22H.
What are the key properties of 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol?
2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol has a molecular weight of 315.27 g/mol, XLogP of 3.90, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol is sourced from PubChem (CID 134158356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).