2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine

C112H164F9N21O16 — CID 161086527

IUPAC2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine
SMILESCC(C)N1CC(Oc2ccc(OC(F)F)nc2)C1.CC(C)N1CC(Oc2cccc(C(F)(F)F)n2)C1.CC(C)N1CCC(Oc2ccc(OC(F)F)nc2)CC1.COc1ccc(OC2CCN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1.Cc1ccc(OC2CN(C(C)C)C2)nn1
InChIInChI=1S/C14H20F2N2O2.C14H21FN2O2.C13H21N3O2.C13H20N2O2.C12H15F3N2O.C12H16F2N2O2.C12H17FN2O2.C11H17N3O2.C11H17N3O/c1-10(2)18-7-5-11(6-8-18)19-12-3-4-13(17-9-12)20-14(15)16;1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-10(2)15-7-6-12(9-15)17-11-4-5-13(16-3)14-8-11;1-8(2)17-6-9(7-17)18-11-5-3-4-10(16-11)12(13,14)15;1-8(2)16-6-10(7-16)17-9-3-4-11(15-5-9)18-12(13)14;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-10(7-14)15-11-5-4-9(3)12-13-11/h3-4,9-11,14H,5-8H2,1-2H3;8-11H,4-7H2,1-3H3;8-11H,4-7H2,1-3H3;4-5,8,10,12H,6-7,9H2,1-3H3;3-5,8-9H,6-7H2,1-2H3;3-5,8,10,12H,6-7H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3
InChIKeyUGOXWQBCRNHDHK-UHFFFAOYSA-N
MW2231.66 g/mol
LogP17.74
Rot. Bonds36

About 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine

2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine (PubChem CID 161086527) has the molecular formula C112H164F9N21O16 and a molecular weight of 2231.66 g/mol. Its IUPAC name is 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine
PubChem CID161086527
Molecular FormulaC112H164F9N21O16
Molecular Weight2231.66 g/mol
Exact Mass2230.25
IUPAC Name2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine
SMILESCC(C)N1CC(Oc2ccc(OC(F)F)nc2)C1.CC(C)N1CC(Oc2cccc(C(F)(F)F)n2)C1.CC(C)N1CCC(Oc2ccc(OC(F)F)nc2)CC1.COc1ccc(OC2CCN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1.Cc1ccc(OC2CN(C(C)C)C2)nn1
InChIInChI=1S/C14H20F2N2O2.C14H21FN2O2.C13H21N3O2.C13H20N2O2.C12H15F3N2O.C12H16F2N2O2.C12H17FN2O2.C11H17N3O2.C11H17N3O/c1-10(2)18-7-5-11(6-8-18)19-12-3-4-13(17-9-12)20-14(15)16;1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-10(2)15-7-6-12(9-15)17-11-4-5-13(16-3)14-8-11;1-8(2)17-6-9(7-17)18-11-5-3-4-10(16-11)12(13,14)15;1-8(2)16-6-10(7-16)17-9-3-4-11(15-5-9)18-12(13)14;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-10(7-14)15-11-5-4-9(3)12-13-11/h3-4,9-11,14H,5-8H2,1-2H3;8-11H,4-7H2,1-3H3;8-11H,4-7H2,1-3H3;4-5,8,10,12H,6-7,9H2,1-3H3;3-5,8-9H,6-7H2,1-2H3;3-5,8,10,12H,6-7H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3
InChIKeyUGOXWQBCRNHDHK-UHFFFAOYSA-N
XLogP17.74
TPSA331.52 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds36
Heavy Atoms158
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002231.66
LogP ≤ 517.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Analyze 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine?
The IUPAC name of 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine (CID 161086527) is 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine is CC(C)N1CC(Oc2ccc(OC(F)F)nc2)C1.CC(C)N1CC(Oc2cccc(C(F)(F)F)n2)C1.CC(C)N1CCC(Oc2ccc(OC(F)F)nc2)CC1.COc1ccc(OC2CCN(C(C)C)C2)cn1.COc1ncc(OC2CCN(C(C)C)CC2)cc1F.COc1ncc(OC2CCN(C(C)C)CC2)cn1.COc1ncc(OC2CN(C(C)C)C2)cc1F.COc1ncc(OC2CN(C(C)C)C2)cn1.Cc1ccc(OC2CN(C(C)C)C2)nn1.
What is the InChIKey of 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine?
The InChIKey is UGOXWQBCRNHDHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O2.C14H21FN2O2.C13H21N3O2.C13H20N2O2.C12H15F3N2O.C12H16F2N2O2.C12H17FN2O2.C11H17N3O2.C11H17N3O/c1-10(2)18-7-5-11(6-8-18)19-12-3-4-13(17-9-12)20-14(15)16;1-10(2)17-6-4-11(5-7-17)19-12-8-13(15)14(18-3)16-9-12;1-10(2)16-6-4-11(5-7-16)18-12-8-14-13(17-3)15-9-12;1-10(2)15-7-6-12(9-15)17-11-4-5-13(16-3)14-8-11;1-8(2)17-6-9(7-17)18-11-5-3-4-10(16-11)12(13,14)15;1-8(2)16-6-10(7-16)17-9-3-4-11(15-5-9)18-12(13)14;1-8(2)15-6-10(7-15)17-9-4-11(13)12(16-3)14-5-9;1-8(2)14-6-10(7-14)16-9-4-12-11(15-3)13-5-9;1-8(2)14-6-10(7-14)15-11-5-4-9(3)12-13-11/h3-4,9-11,14H,5-8H2,1-2H3;8-11H,4-7H2,1-3H3;8-11H,4-7H2,1-3H3;4-5,8,10,12H,6-7,9H2,1-3H3;3-5,8-9H,6-7H2,1-2H3;3-5,8,10,12H,6-7H2,1-2H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3;4-5,8,10H,6-7H2,1-3H3.
What are the key properties of 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine?
2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine has a molecular weight of 2231.66 g/mol, XLogP of 17.74, 36 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(difluoromethoxy)-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-fluoro-2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;2-methoxy-5-(1-propan-2-ylazetidin-3-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-methoxy-5-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine;3-methyl-6-(1-propan-2-ylazetidin-3-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxy-6-(trifluoromethyl)pyridine is sourced from PubChem (CID 161086527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).