5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine

C156H158F24N10O11 — CID 173378056

IUPAC5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine
SMILESCCCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCOc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)F)nc2)cc1
InChIInChI=1S/C18H21F2NO.C17H18F3NO.C17H19F2NO.C16H16F3NO.C16H17F2NO.C15H14F3NO.C15H15F2NO.C14H12F3NO.C14H13F2NO2.C14H13F2NO/c1-2-3-4-5-6-14-7-9-15(10-8-14)16-11-12-17(21-13-16)22-18(19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(21-12-15)22-17(18,19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(20-12-15)21-17(18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(20-11-14)21-16(17,18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(19-11-14)20-16(17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(19-10-13)20-15(16,17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(18-10-13)19-15(16)17;1-2-10-3-5-11(6-4-10)12-7-8-13(18-9-12)19-14(15,16)17;1-2-18-12-6-3-10(4-7-12)11-5-8-13(17-9-11)19-14(15)16;1-2-10-3-5-11(6-4-10)12-7-8-13(17-9-12)18-14(15)16/h7-13,18H,2-6H2,1H3;6-12H,2-5H2,1H3;6-12,17H,2-5H2,1H3;5-11H,2-4H2,1H3;5-11,16H,2-4H2,1H3;4-10H,2-3H2,1H3;4-10,15H,2-3H2,1H3;3-9H,2H2,1H3;3-9,14H,2H2,1H3;3-9,14H,2H2,1H3
InChIKeyFWXWQPHVLRXBJF-UHFFFAOYSA-N
MW2804.99 g/mol
LogP46.39
Rot. Bonds53

About 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine

5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine (PubChem CID 173378056) has the molecular formula C156H158F24N10O11 and a molecular weight of 2804.99 g/mol. Its IUPAC name is 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine
PubChem CID173378056
Molecular FormulaC156H158F24N10O11
Molecular Weight2804.99 g/mol
Exact Mass2803.17
IUPAC Name5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine
SMILESCCCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCOc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)F)nc2)cc1
InChIInChI=1S/C18H21F2NO.C17H18F3NO.C17H19F2NO.C16H16F3NO.C16H17F2NO.C15H14F3NO.C15H15F2NO.C14H12F3NO.C14H13F2NO2.C14H13F2NO/c1-2-3-4-5-6-14-7-9-15(10-8-14)16-11-12-17(21-13-16)22-18(19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(21-12-15)22-17(18,19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(20-12-15)21-17(18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(20-11-14)21-16(17,18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(19-11-14)20-16(17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(19-10-13)20-15(16,17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(18-10-13)19-15(16)17;1-2-10-3-5-11(6-4-10)12-7-8-13(18-9-12)19-14(15,16)17;1-2-18-12-6-3-10(4-7-12)11-5-8-13(17-9-11)19-14(15)16;1-2-10-3-5-11(6-4-10)12-7-8-13(17-9-12)18-14(15)16/h7-13,18H,2-6H2,1H3;6-12H,2-5H2,1H3;6-12,17H,2-5H2,1H3;5-11H,2-4H2,1H3;5-11,16H,2-4H2,1H3;4-10H,2-3H2,1H3;4-10,15H,2-3H2,1H3;3-9H,2H2,1H3;3-9,14H,2H2,1H3;3-9,14H,2H2,1H3
InChIKeyFWXWQPHVLRXBJF-UHFFFAOYSA-N
XLogP46.39
TPSA230.43 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds53
Heavy Atoms201
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002804.99
LogP ≤ 546.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine?
The IUPAC name of 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine (CID 173378056) is 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine.
What is the SMILES notation for 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine?
The canonical SMILES for 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine is CCCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCCc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCOc1ccc(-c2ccc(OC(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)(F)F)nc2)cc1.CCc1ccc(-c2ccc(OC(F)F)nc2)cc1.
What is the InChIKey of 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine?
The InChIKey is FWXWQPHVLRXBJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21F2NO.C17H18F3NO.C17H19F2NO.C16H16F3NO.C16H17F2NO.C15H14F3NO.C15H15F2NO.C14H12F3NO.C14H13F2NO2.C14H13F2NO/c1-2-3-4-5-6-14-7-9-15(10-8-14)16-11-12-17(21-13-16)22-18(19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(21-12-15)22-17(18,19)20;1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(20-12-15)21-17(18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(20-11-14)21-16(17,18)19;1-2-3-4-12-5-7-13(8-6-12)14-9-10-15(19-11-14)20-16(17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(19-10-13)20-15(16,17)18;1-2-3-11-4-6-12(7-5-11)13-8-9-14(18-10-13)19-15(16)17;1-2-10-3-5-11(6-4-10)12-7-8-13(18-9-12)19-14(15,16)17;1-2-18-12-6-3-10(4-7-12)11-5-8-13(17-9-11)19-14(15)16;1-2-10-3-5-11(6-4-10)12-7-8-13(17-9-12)18-14(15)16/h7-13,18H,2-6H2,1H3;6-12H,2-5H2,1H3;6-12,17H,2-5H2,1H3;5-11H,2-4H2,1H3;5-11,16H,2-4H2,1H3;4-10H,2-3H2,1H3;4-10,15H,2-3H2,1H3;3-9H,2H2,1H3;3-9,14H,2H2,1H3;3-9,14H,2H2,1H3.
What are the key properties of 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine?
5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine has a molecular weight of 2804.99 g/mol, XLogP of 46.39, 53 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-butylphenyl)-2-(difluoromethoxy)pyridine;5-(4-butylphenyl)-2-(trifluoromethoxy)pyridine;2-(difluoromethoxy)-5-(4-ethoxyphenyl)pyridine;2-(difluoromethoxy)-5-(4-ethylphenyl)pyridine;2-(difluoromethoxy)-5-(4-hexylphenyl)pyridine;2-(difluoromethoxy)-5-(4-pentylphenyl)pyridine;2-(difluoromethoxy)-5-(4-propylphenyl)pyridine;5-(4-ethylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-pentylphenyl)-2-(trifluoromethoxy)pyridine;5-(4-propylphenyl)-2-(trifluoromethoxy)pyridine is sourced from PubChem (CID 173378056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).