4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide

C71H69Cl3F3N7O10 — CID 159530260

About 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide

4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide (PubChem CID 159530260) has the molecular formula C71H69Cl3F3N7O10 and a molecular weight of 1343.72 g/mol. Its IUPAC name is 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide
• PubChem CID: 159530260
• Molecular Formula: C71H69Cl3F3N7O10
• Molecular Weight: 1343.72 g/mol
• Exact Mass: 1341.41
• IUPAC Name: 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide
• SMILES: Cc1cc(C)c(C2C(=O)C[C@@H](CCNC(=O)c3cc(Cl)ccn3)C2=O)c(C)c1.Cc1cc(C)c(C2C(=O)C[C@H](CCNC(=O)c3cc(Cl)ccn3)C2=O)c(C)c1.Cc1cc(Oc2ncc(C(F)(F)F)cc2Cl)cc(C)c1C1C(=O)CC(CCNC(=O)c2ccccn2)C1=O
• InChI: InChI=1S/C27H23ClF3N3O4.2C22H23ClN2O3/c1-14-9-18(38-26-19(28)12-17(13-34-26)27(29,30)31)10-15(2)22(14)23-21(35)11-16(24(23)36)6-8-33-25(37)20-5-3-4-7-32-20;2*1-12-8-13(2)19(14(3)9-12)20-18(26)10-15(21(20)27)4-6-25-22(28)17-11-16(23)5-7-24-17/h3-5,7,9-10,12-13,16,23H,6,8,11H2,1-2H3,(H,33,37);2*5,7-9,11,15,20H,4,6,10H2,1-3H3,(H,25,28)/t;2*15-,20?/m.10/s1
• InChIKey: MCXDFTVHDCRNEO-TYCDYJHNSA-N
• XLogP: 13.06
• TPSA: 250.51 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 14
• Rotatable Bonds: 17
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1343.72
LogP ≤ 5	13.06
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide?

The IUPAC name of 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide (CID 159530260) is 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide.

What is the SMILES notation for 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide?

The canonical SMILES for 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide is Cc1cc(C)c(C2C(=O)C[C@@H](CCNC(=O)c3cc(Cl)ccn3)C2=O)c(C)c1.Cc1cc(C)c(C2C(=O)C[C@H](CCNC(=O)c3cc(Cl)ccn3)C2=O)c(C)c1.Cc1cc(Oc2ncc(C(F)(F)F)cc2Cl)cc(C)c1C1C(=O)CC(CCNC(=O)c2ccccn2)C1=O.

What is the InChIKey of 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide?

The InChIKey is MCXDFTVHDCRNEO-TYCDYJHNSA-N. The full InChI is InChI=1S/C27H23ClF3N3O4.2C22H23ClN2O3/c1-14-9-18(38-26-19(28)12-17(13-34-26)27(29,30)31)10-15(2)22(14)23-21(35)11-16(24(23)36)6-8-33-25(37)20-5-3-4-7-32-20;2*1-12-8-13(2)19(14(3)9-12)20-18(26)10-15(21(20)27)4-6-25-22(28)17-11-16(23)5-7-24-17/h3-5,7,9-10,12-13,16,23H,6,8,11H2,1-2H3,(H,33,37);2*5,7-9,11,15,20H,4,6,10H2,1-3H3,(H,25,28)/t;2*15-,20?/m.10/s1.

What are the key properties of 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide?

4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide has a molecular weight of 1343.72 g/mol, XLogP of 13.06, 17 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-[2-[(1R)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;4-chloro-N-[2-[(1S)-2,4-dioxo-3-(2,4,6-trimethylphenyl)cyclopentyl]ethyl]pyridine-2-carboxamide;N-[2-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2,6-dimethylphenyl]-2,4-dioxocyclopentyl]ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 159530260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).