3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine

C12H8ClF2NO — CID 144726616

IUPAC3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine
SMILESFC(F)Oc1ncccc1-c1cccc(Cl)c1
InChIInChI=1S/C12H8ClF2NO/c13-9-4-1-3-8(7-9)10-5-2-6-16-11(10)17-12(14)15/h1-7,12H
InChIKeyWQVNESOLXNAQQL-UHFFFAOYSA-N
MW255.65 g/mol
LogP4.00
Rot. Bonds3

About 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine

3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine (PubChem CID 144726616) has the molecular formula C12H8ClF2NO and a molecular weight of 255.65 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine.

Molecular Properties

Compound Name3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine
PubChem CID144726616
Molecular FormulaC12H8ClF2NO
Molecular Weight255.65 g/mol
Exact Mass255.03
IUPAC Name3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine
SMILESFC(F)Oc1ncccc1-c1cccc(Cl)c1
InChIInChI=1S/C12H8ClF2NO/c13-9-4-1-3-8(7-9)10-5-2-6-16-11(10)17-12(14)15/h1-7,12H
InChIKeyWQVNESOLXNAQQL-UHFFFAOYSA-N
XLogP4.00
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.65
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-Chlorophenyl)methoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263326
2-[1-(3-Chlorophenyl)-2,2,2-trifluoroethoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263339
3-(3-(3-Chlorobenzyloxy)-5-methylphenyl)pyridine
CID 44409820
2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
CID 514904
6-chloro-2-(4-chlorophenyl)-2H-pyrano[2,3-b]pyridine
CID 514907
US10155760, Example 193
CID 118429814
4-(6-Chloro-2,2-dimethylchromen-4-yl)pyridine;hydrochloride
CID 44523133
3-(2-Trifluoromethoxybenzylidene)anabaseine
CID 46702871
3-(2-Difluoromethoxybenzylidene)anabaseine
CID 46702873
(E)-3-[2-chloro-4-(2-methoxy-3-pyridinyl)phenyl]-N-hydroxyprop-2-enamide
CID 70694321
2-[(2,6-Dichlorophenyl)methoxy]pyridine
CID 648335
2-[(2,4-Dichlorobenzyl)oxy]pyridine
CID 658875

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine?
The IUPAC name of 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine (CID 144726616) is 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine.
What is the SMILES notation for 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine?
The canonical SMILES for 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine is FC(F)Oc1ncccc1-c1cccc(Cl)c1.
What is the InChIKey of 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine?
The InChIKey is WQVNESOLXNAQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF2NO/c13-9-4-1-3-8(7-9)10-5-2-6-16-11(10)17-12(14)15/h1-7,12H.
What are the key properties of 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine?
3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine has a molecular weight of 255.65 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-2-(difluoromethoxy)pyridine is sourced from PubChem (CID 144726616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).