3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine

C13H9ClF3NO — CID 167152492

IUPAC3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
SMILESFC(F)(F)c1ccc(COc2ncccc2Cl)cc1
InChIInChI=1S/C13H9ClF3NO/c14-11-2-1-7-18-12(11)19-8-9-3-5-10(6-4-9)13(15,16)17/h1-7H,8H2
InChIKeyWRQMVUMKNDYNLT-UHFFFAOYSA-N
MW287.67 g/mol
LogP4.33
Rot. Bonds3

About 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine

3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine (PubChem CID 167152492) has the molecular formula C13H9ClF3NO and a molecular weight of 287.67 g/mol. Its IUPAC name is 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine.

Molecular Properties

Compound Name3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
PubChem CID167152492
Molecular FormulaC13H9ClF3NO
Molecular Weight287.67 g/mol
Exact Mass287.03
IUPAC Name3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
SMILESFC(F)(F)c1ccc(COc2ncccc2Cl)cc1
InChIInChI=1S/C13H9ClF3NO/c14-11-2-1-7-18-12(11)19-8-9-3-5-10(6-4-9)13(15,16)17/h1-7H,8H2
InChIKeyWRQMVUMKNDYNLT-UHFFFAOYSA-N
XLogP4.33
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.67
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[4-(trifluoromethyl)phenyl]methoxy]pyridazine
CID 134106459
N-(3-chloro-2-pyridinyl)-2-[4-(trifluoromethyl)phenyl]acetamide
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3-chloro-2-(2,2,3,3,4,4,5,5,5-nonafluoropentoxy)pyridine
CID 167152496
4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxymethyl]benzoyl chloride
CID 15334422
2-chloro-4-(chloromethyl)-1-[[4-(trifluoromethyl)phenyl]methoxy]benzene
CID 63536063
4-chloro-3-[[4-(trifluoromethyl)phenyl]methoxy]phenol
CID 142618666
1-(trifluoromethyl)-2-[[4-(trifluoromethyl)phenyl]methoxy]benzene
CID 174057400
6-bromo-3-fluoro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
CID 166089135
2-(chloromethyl)-4-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
CID 14425986
1-(3-chloro-2-pyridinyl)-2-[4-(trifluoromethyl)phenyl]hydrazine
CID 141429502
[2-chloro-4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]methanamine
CID 102723774
1-tert-butyl-4-[[4-(trifluoromethyl)phenoxy]methyl]benzene
CID 171509643

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine?
The IUPAC name of 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine (CID 167152492) is 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine.
What is the SMILES notation for 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine?
The canonical SMILES for 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine is FC(F)(F)c1ccc(COc2ncccc2Cl)cc1.
What is the InChIKey of 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine?
The InChIKey is WRQMVUMKNDYNLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF3NO/c14-11-2-1-7-18-12(11)19-8-9-3-5-10(6-4-9)13(15,16)17/h1-7H,8H2.
What are the key properties of 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine?
3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine has a molecular weight of 287.67 g/mol, XLogP of 4.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine is sourced from PubChem (CID 167152492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).