5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide

C55H53N11O6 — CID 159762639

About 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide

5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 159762639) has the molecular formula C55H53N11O6 and a molecular weight of 964.10 g/mol. Its IUPAC name is 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide
• PubChem CID: 159762639
• Molecular Formula: C55H53N11O6
• Molecular Weight: 964.10 g/mol
• Exact Mass: 963.42
• IUPAC Name: 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide
• SMILES: Cc1cc(C(=O)N[C@@H]2[C@@H](c3ccccc3)N(c3ccc4c(cnn4-c4ccc(=O)n(C)c4)c3)C(=O)C2(C)C)no1.Cn1cc(-n2ncc3cc(N4C(=O)C(C)(C)[C@H](N)[C@H]4c4ccccc4)ccc32)ccc1=O
• InChI: InChI=1S/C30H28N6O4.C25H25N5O2/c1-18-14-23(33-40-18)28(38)32-27-26(19-8-6-5-7-9-19)35(29(39)30(27,2)3)21-10-12-24-20(15-21)16-31-36(24)22-11-13-25(37)34(4)17-22;1-25(2)23(26)22(16-7-5-4-6-8-16)29(24(25)32)18-9-11-20-17(13-18)14-27-30(20)19-10-12-21(31)28(3)15-19/h5-17,26-27H,1-4H3,(H,32,38);4-15,22-23H,26H2,1-3H3/t26-,27-;22-,23-/m11/s1
• InChIKey: NFBYCTRMNBWARA-MHPVSYBKSA-N
• XLogP: 7.10
• TPSA: 201.41 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 14
• Rotatable Bonds: 8
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	964.10
LogP ≤ 5	7.10
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide?

The IUPAC name of 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide (CID 159762639) is 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide.

What is the SMILES notation for 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide?

The canonical SMILES for 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)N[C@@H]2[C@@H](c3ccccc3)N(c3ccc4c(cnn4-c4ccc(=O)n(C)c4)c3)C(=O)C2(C)C)no1.Cn1cc(-n2ncc3cc(N4C(=O)C(C)(C)[C@H](N)[C@H]4c4ccccc4)ccc32)ccc1=O.

What is the InChIKey of 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide?

The InChIKey is NFBYCTRMNBWARA-MHPVSYBKSA-N. The full InChI is InChI=1S/C30H28N6O4.C25H25N5O2/c1-18-14-23(33-40-18)28(38)32-27-26(19-8-6-5-7-9-19)35(29(39)30(27,2)3)21-10-12-24-20(15-21)16-31-36(24)22-11-13-25(37)34(4)17-22;1-25(2)23(26)22(16-7-5-4-6-8-16)29(24(25)32)18-9-11-20-17(13-18)14-27-30(20)19-10-12-21(31)28(3)15-19/h5-17,26-27H,1-4H3,(H,32,38);4-15,22-23H,26H2,1-3H3/t26-,27-;22-,23-/m11/s1.

What are the key properties of 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide?

5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 964.10 g/mol, XLogP of 7.10, 8 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-[(4S,5R)-4-amino-3,3-dimethyl-2-oxo-5-phenylpyrrolidin-1-yl]indazol-1-yl]-1-methylpyridin-2-one;N-[(2R,3S)-4,4-dimethyl-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxo-2-phenylpyrrolidin-3-yl]-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 159762639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).