3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine

C12H9F2NO — CID 165479125

IUPAC3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine
SMILESCOc1cc(F)cc(-c2ccncc2F)c1
InChIInChI=1S/C12H9F2NO/c1-16-10-5-8(4-9(13)6-10)11-2-3-15-7-12(11)14/h2-7H,1H3
InChIKeyMXWPZMKEBCGZNH-UHFFFAOYSA-N
MW221.21 g/mol
LogP3.04
Rot. Bonds2

About 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine

3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine (PubChem CID 165479125) has the molecular formula C12H9F2NO and a molecular weight of 221.21 g/mol. Its IUPAC name is 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine.

Molecular Properties

Compound Name3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine
PubChem CID165479125
Molecular FormulaC12H9F2NO
Molecular Weight221.21 g/mol
Exact Mass221.07
IUPAC Name3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine
SMILESCOc1cc(F)cc(-c2ccncc2F)c1
InChIInChI=1S/C12H9F2NO/c1-16-10-5-8(4-9(13)6-10)11-2-3-15-7-12(11)14/h2-7H,1H3
InChIKeyMXWPZMKEBCGZNH-UHFFFAOYSA-N
XLogP3.04
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.21
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluoro-5-methoxyphenyl)pyrazine
CID 166161834
1,2,3-trifluoro-4-(3-fluoro-5-methoxyphenyl)benzene
CID 165487058
1,2-difluoro-3-(3-fluoro-5-methoxyphenyl)benzene
CID 134627065
3-fluoro-4-(4-fluorophenyl)pyridine
CID 46312739
2,3-dichloro-4-[2-chloro-3-(3-fluoro-5-methoxyphenyl)phenyl]pyridine
CID 175512944
4-(3,5-dimethoxyphenyl)pyridine-3-carboxylic acid
CID 53229470
4-(3-fluoro-5-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117315496
5-(3-fluoro-5-methoxyphenyl)pyridin-3-amine
CID 168655350
3-[4-(3-fluoro-5-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-5-(4-methyl-3-pyridinyl)-1H-indazole
CID 137283179
3-fluoro-4-(6-methoxy-1,3-benzodioxol-5-yl)pyridine
CID 163311853
N-[(4,6-dimethylpyrimidin-2-yl)methyl]-3-fluoro-5-(3-fluoro-4-pyridinyl)benzamide
CID 169419498
3-[3-fluoro-5-(2-methylphenyl)phenoxy]pyridine
CID 70949069

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine?
The IUPAC name of 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine (CID 165479125) is 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine.
What is the SMILES notation for 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine?
The canonical SMILES for 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine is COc1cc(F)cc(-c2ccncc2F)c1.
What is the InChIKey of 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine?
The InChIKey is MXWPZMKEBCGZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO/c1-16-10-5-8(4-9(13)6-10)11-2-3-15-7-12(11)14/h2-7H,1H3.
What are the key properties of 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine?
3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine has a molecular weight of 221.21 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine is sourced from PubChem (CID 165479125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).