4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide

C65H64N6O10 — CID 159390053

About 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide

4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide (PubChem CID 159390053) has the molecular formula C65H64N6O10 and a molecular weight of 1089.26 g/mol. Its IUPAC name is 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
• PubChem CID: 159390053
• Molecular Formula: C65H64N6O10
• Molecular Weight: 1089.26 g/mol
• Exact Mass: 1088.47
• IUPAC Name: 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
• SMILES: COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2cc(N3C[C@@H](c4ccc(OC)c(OCc5ccccc5)c4)CC3=O)ccn2)cc1.COc1ccc([C@H]2CC(=O)N(c3ccnc(C(N)=O)c3)C2)cc1Oc1c(C)cccc1C
• InChI: InChI=1S/C40H39N3O6.C25H25N3O4/c1-46-34-14-9-28(10-15-34)24-42(25-29-11-16-35(47-2)17-12-29)40(45)36-23-33(19-20-41-36)43-26-32(22-39(43)44)31-13-18-37(48-3)38(21-31)49-27-30-7-5-4-6-8-30;1-15-5-4-6-16(2)24(15)32-22-11-17(7-8-21(22)31-3)18-12-23(29)28(14-18)19-9-10-27-20(13-19)25(26)30/h4-21,23,32H,22,24-27H2,1-3H3;4-11,13,18H,12,14H2,1-3H3,(H2,26,30)/t32-;18-/m00/s1
• InChIKey: LLZMTVNKNBPZJU-NVKGTVEISA-N
• XLogP: 11.17
• TPSA: 185.18 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 12
• Rotatable Bonds: 19
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1089.26
LogP ≤ 5	11.17
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?

The IUPAC name of 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide (CID 159390053) is 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide.

What is the SMILES notation for 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?

The canonical SMILES for 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide is COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2cc(N3C[C@@H](c4ccc(OC)c(OCc5ccccc5)c4)CC3=O)ccn2)cc1.COc1ccc([C@H]2CC(=O)N(c3ccnc(C(N)=O)c3)C2)cc1Oc1c(C)cccc1C.

What is the InChIKey of 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?

The InChIKey is LLZMTVNKNBPZJU-NVKGTVEISA-N. The full InChI is InChI=1S/C40H39N3O6.C25H25N3O4/c1-46-34-14-9-28(10-15-34)24-42(25-29-11-16-35(47-2)17-12-29)40(45)36-23-33(19-20-41-36)43-26-32(22-39(43)44)31-13-18-37(48-3)38(21-31)49-27-30-7-5-4-6-8-30;1-15-5-4-6-16(2)24(15)32-22-11-17(7-8-21(22)31-3)18-12-23(29)28(14-18)19-9-10-27-20(13-19)25(26)30/h4-21,23,32H,22,24-27H2,1-3H3;4-11,13,18H,12,14H2,1-3H3,(H2,26,30)/t32-;18-/m00/s1.

What are the key properties of 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide?

4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide has a molecular weight of 1089.26 g/mol, XLogP of 11.17, 19 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(4R)-4-[3-(2,6-dimethylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]pyridine-2-carboxamide;4-[(4R)-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxopyrrolidin-1-yl]-N,N-bis[(4-methoxyphenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 159390053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).