N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide

C123H120ClF6N11O16 — CID 167671290

About N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide

N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide (PubChem CID 167671290) has the molecular formula C123H120ClF6N11O16 and a molecular weight of 2157.81 g/mol. Its IUPAC name is N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide.

Molecular Properties

• Compound Name: N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide
• PubChem CID: 167671290
• Molecular Formula: C123H120ClF6N11O16
• Molecular Weight: 2157.81 g/mol
• Exact Mass: 2155.85
• IUPAC Name: N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide
• SMILES: CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3C)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(Cl)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(N)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(OC)nc3)cc2O)cc1F
• InChI: InChI=1S/C26H27FN2O3.C25H25FN2O4.C24H22ClFN2O3.C24H22F2N2O3.C24H24FN3O3/c1-5-26(32)29(4)23-12-9-19(14-22(23)27)21-11-8-20(15-25(21)31)24(30)13-10-18-7-6-16(2)28-17(18)3;1-4-25(31)28(2)21-10-8-17(13-20(21)26)19-9-7-18(14-23(19)30)22(29)11-5-16-6-12-24(32-3)27-15-16;1-3-24(31)28(2)20-9-7-16(12-19(20)26)18-8-6-17(13-22(18)30)21(29)10-4-15-5-11-23(25)27-14-15;2*1-3-24(31)28(2)20-9-7-16(12-19(20)25)18-8-6-17(13-22(18)30)21(29)10-4-15-5-11-23(26)27-14-15/h6-9,11-12,14-15,31H,5,10,13H2,1-4H3;6-10,12-15,30H,4-5,11H2,1-3H3;2*5-9,11-14,30H,3-4,10H2,1-2H3;5-9,11-14,30H,3-4,10H2,1-2H3,(H2,26,27)
• InChIKey: UDNWUUNLADVUSY-UHFFFAOYSA-N
• XLogP: 24.91
• TPSA: 387.75 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 22
• Rotatable Bonds: 36
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2157.81
LogP ≤ 5	24.91
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide?

The IUPAC name of N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide (CID 167671290) is N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide.

What is the SMILES notation for N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide?

The canonical SMILES for N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide is CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(C)nc3C)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(Cl)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(F)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(N)nc3)cc2O)cc1F.CCC(=O)N(C)c1ccc(-c2ccc(C(=O)CCc3ccc(OC)nc3)cc2O)cc1F.

What is the InChIKey of N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide?

The InChIKey is UDNWUUNLADVUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27FN2O3.C25H25FN2O4.C24H22ClFN2O3.C24H22F2N2O3.C24H24FN3O3/c1-5-26(32)29(4)23-12-9-19(14-22(23)27)21-11-8-20(15-25(21)31)24(30)13-10-18-7-6-16(2)28-17(18)3;1-4-25(31)28(2)21-10-8-17(13-20(21)26)19-9-7-18(14-23(19)30)22(29)11-5-16-6-12-24(32-3)27-15-16;1-3-24(31)28(2)20-9-7-16(12-19(20)26)18-8-6-17(13-22(18)30)21(29)10-4-15-5-11-23(25)27-14-15;2*1-3-24(31)28(2)20-9-7-16(12-19(20)25)18-8-6-17(13-22(18)30)21(29)10-4-15-5-11-23(26)27-14-15/h6-9,11-12,14-15,31H,5,10,13H2,1-4H3;6-10,12-15,30H,4-5,11H2,1-3H3;2*5-9,11-14,30H,3-4,10H2,1-2H3;5-9,11-14,30H,3-4,10H2,1-2H3,(H2,26,27).

What are the key properties of N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide?

N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide has a molecular weight of 2157.81 g/mol, XLogP of 24.91, 36 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-[3-(6-amino-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(6-chloro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[4-[4-[3-(2,6-dimethyl-3-pyridinyl)propanoyl]-2-hydroxyphenyl]-2-fluorophenyl]-N-methylpropanamide;N-[2-fluoro-4-[4-[3-(6-fluoro-3-pyridinyl)propanoyl]-2-hydroxyphenyl]phenyl]-N-methylpropanamide;N-[2-fluoro-4-[2-hydroxy-4-[3-(6-methoxy-3-pyridinyl)propanoyl]phenyl]phenyl]-N-methylpropanamide is sourced from PubChem (CID 167671290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).