[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone

C143H165F7N12O12 — CID 157470582

About [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone

[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone (PubChem CID 157470582) has the molecular formula C143H165F7N12O12 and a molecular weight of 2376.95 g/mol. Its IUPAC name is [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone.

Molecular Properties

• Compound Name: [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone
• PubChem CID: 157470582
• Molecular Formula: C143H165F7N12O12
• Molecular Weight: 2376.95 g/mol
• Exact Mass: 2375.26
• IUPAC Name: [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone
• SMILES: CC(F)(F)c1cccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)n2)c1.CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2cccc(COc3cccc(C(F)(F)F)c3)n2)C1.CCC1CCC(C)N(C(=O)c2cccc(COc3cccc(C(C)(F)F)c3)n2)C1.CCC1CCCCN1C(=O)c1cccc(COc2ccc(C)cc2C)n1.Cc1ccc(OCc2cccc(C(=O)N3CC(C)CC(C)C3)n2)c(C)c1.Cc1ccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)n2)c(C)c1
• InChI: InChI=1S/C26H26F2N2O2.C26H28N2O2.C24H27F3N2O2.C23H28F2N2O2.2C22H28N2O2/c1-26(27,28)21-9-5-11-23(17-21)32-18-22-10-6-12-24(29-22)25(31)30-15-13-20(14-16-30)19-7-3-2-4-8-19;1-19-11-12-25(20(2)17-19)30-18-23-9-6-10-24(27-23)26(29)28-15-13-22(14-16-28)21-7-4-3-5-8-21;1-22(2)11-18-12-23(3,14-22)15-29(18)21(30)20-9-5-7-17(28-20)13-31-19-8-4-6-16(10-19)24(25,26)27;1-4-17-12-11-16(2)27(14-17)22(28)21-10-6-8-19(26-21)15-29-20-9-5-7-18(13-20)23(3,24)25;1-15-8-9-21(18(4)11-15)26-14-19-6-5-7-20(23-19)22(25)24-12-16(2)10-17(3)13-24;1-4-19-9-5-6-13-24(19)22(25)20-10-7-8-18(23-20)15-26-21-12-11-16(2)14-17(21)3/h2-12,17,20H,13-16,18H2,1H3;3-12,17,22H,13-16,18H2,1-2H3;4-10,18H,11-15H2,1-3H3;5-10,13,16-17H,4,11-12,14-15H2,1-3H3;5-9,11,16-17H,10,12-14H2,1-4H3;7-8,10-12,14,19H,4-6,9,13,15H2,1-3H3/t;;18-,23-;;;/m..1.../s1
• InChIKey: BUZGYXBIGWYDPR-BRLLJSIVSA-N
• XLogP: 31.31
• TPSA: 254.58 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 30
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2376.95
LogP ≤ 5	31.31
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone?

The IUPAC name of [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone (CID 157470582) is [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone.

What is the SMILES notation for [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone?

The canonical SMILES for [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone is CC(F)(F)c1cccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)n2)c1.CC1(C)C[C@@H]2C[C@@](C)(CN2C(=O)c2cccc(COc3cccc(C(F)(F)F)c3)n2)C1.CCC1CCC(C)N(C(=O)c2cccc(COc3cccc(C(C)(F)F)c3)n2)C1.CCC1CCCCN1C(=O)c1cccc(COc2ccc(C)cc2C)n1.Cc1ccc(OCc2cccc(C(=O)N3CC(C)CC(C)C3)n2)c(C)c1.Cc1ccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)n2)c(C)c1.

What is the InChIKey of [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone?

The InChIKey is BUZGYXBIGWYDPR-BRLLJSIVSA-N. The full InChI is InChI=1S/C26H26F2N2O2.C26H28N2O2.C24H27F3N2O2.C23H28F2N2O2.2C22H28N2O2/c1-26(27,28)21-9-5-11-23(17-21)32-18-22-10-6-12-24(29-22)25(31)30-15-13-20(14-16-30)19-7-3-2-4-8-19;1-19-11-12-25(20(2)17-19)30-18-23-9-6-10-24(27-23)26(29)28-15-13-22(14-16-28)21-7-4-3-5-8-21;1-22(2)11-18-12-23(3,14-22)15-29(18)21(30)20-9-5-7-17(28-20)13-31-19-8-4-6-16(10-19)24(25,26)27;1-4-17-12-11-16(2)27(14-17)22(28)21-10-6-8-19(26-21)15-29-20-9-5-7-18(13-20)23(3,24)25;1-15-8-9-21(18(4)11-15)26-14-19-6-5-7-20(23-19)22(25)24-12-16(2)10-17(3)13-24;1-4-19-9-5-6-13-24(19)22(25)20-10-7-8-18(23-20)15-26-21-12-11-16(2)14-17(21)3/h2-12,17,20H,13-16,18H2,1H3;3-12,17,22H,13-16,18H2,1-2H3;4-10,18H,11-15H2,1-3H3;5-10,13,16-17H,4,11-12,14-15H2,1-3H3;5-9,11,16-17H,10,12-14H2,1-4H3;7-8,10-12,14,19H,4-6,9,13,15H2,1-3H3/t;;18-,23-;;;/m..1.../s1.

What are the key properties of [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone?

[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone has a molecular weight of 2376.95 g/mol, XLogP of 31.31, 30 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for [6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(5-ethyl-2-methylpiperidin-1-yl)methanone;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,4-dimethylphenoxy)methyl]-2-pyridinyl]-(4-phenylpiperidin-1-yl)methanone;[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methanone is sourced from PubChem (CID 157470582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).