(3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide

C114H98ClF21N12O13 — CID 165019915

About (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide

(3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide (PubChem CID 165019915) has the molecular formula C114H98ClF21N12O13 and a molecular weight of 2278.52 g/mol. Its IUPAC name is (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide.

Molecular Properties

• Compound Name: (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide
• PubChem CID: 165019915
• Molecular Formula: C114H98ClF21N12O13
• Molecular Weight: 2278.52 g/mol
• Exact Mass: 2276.67
• IUPAC Name: (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide
• SMILES: CN1CCC(c2ccc(F)cc2)[C@@H](C(=O)Nc2cccc(F)c2F)C1=O.CN1CCC(c2cccc(OC(F)(F)F)c2)C(C(=O)Nc2ccccc2F)C1=O.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1ccc(F)c(F)c1F.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1cccc(F)c1F.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1ccccc1F.O=C1NCC[C@H](c2cccc(Cl)c2)[C@H]1C(=O)Nc1cccc(F)c1F
• InChI: InChI=1S/C20H18F4N2O3.C19H15F5N2O2.C19H16F4N2O2.2C19H17F3N2O2.C18H15ClF2N2O2/c1-26-10-9-14(12-5-4-6-13(11-12)29-20(22,23)24)17(19(26)28)18(27)25-16-8-3-2-7-15(16)21;20-12-4-5-13(16(22)15(12)21)26-19(28)14-11(6-7-25-18(14)27)9-2-1-3-10(8-9)17(23)24;20-13-5-2-6-14(16(13)21)25-19(27)15-12(7-8-24-18(15)26)10-3-1-4-11(9-10)17(22)23;1-24-10-9-13(11-5-7-12(20)8-6-11)16(19(24)26)18(25)23-15-4-2-3-14(21)17(15)22;20-14-6-1-2-7-15(14)24-19(26)16-13(8-9-23-18(16)25)11-4-3-5-12(10-11)17(21)22;19-11-4-1-3-10(9-11)12-7-8-22-17(24)15(12)18(25)23-14-6-2-5-13(20)16(14)21/h2-8,11,14,17H,9-10H2,1H3,(H,25,27);1-5,8,11,14,17H,6-7H2,(H,25,27)(H,26,28);1-6,9,12,15,17H,7-8H2,(H,24,26)(H,25,27);2-8,13,16H,9-10H2,1H3,(H,23,25);1-7,10,13,16-17H,8-9H2,(H,23,25)(H,24,26);1-6,9,12,15H,7-8H2,(H,22,24)(H,23,25)/t;;;13?,16-;;12-,15-/m...0.1/s1
• InChIKey: KZSRCGDRBMAREC-KMSCCXMOSA-N
• XLogP: 21.99
• TPSA: 340.85 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 13
• Rotatable Bonds: 22
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2278.52
LogP ≤ 5	21.99
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide?

The IUPAC name of (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide (CID 165019915) is (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide.

What is the SMILES notation for (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide?

The canonical SMILES for (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide is CN1CCC(c2ccc(F)cc2)[C@@H](C(=O)Nc2cccc(F)c2F)C1=O.CN1CCC(c2cccc(OC(F)(F)F)c2)C(C(=O)Nc2ccccc2F)C1=O.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1ccc(F)c(F)c1F.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1cccc(F)c1F.O=C1NCCC(c2cccc(C(F)F)c2)C1C(=O)Nc1ccccc1F.O=C1NCC[C@H](c2cccc(Cl)c2)[C@H]1C(=O)Nc1cccc(F)c1F.

What is the InChIKey of (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide?

The InChIKey is KZSRCGDRBMAREC-KMSCCXMOSA-N. The full InChI is InChI=1S/C20H18F4N2O3.C19H15F5N2O2.C19H16F4N2O2.2C19H17F3N2O2.C18H15ClF2N2O2/c1-26-10-9-14(12-5-4-6-13(11-12)29-20(22,23)24)17(19(26)28)18(27)25-16-8-3-2-7-15(16)21;20-12-4-5-13(16(22)15(12)21)26-19(28)14-11(6-7-25-18(14)27)9-2-1-3-10(8-9)17(23)24;20-13-5-2-6-14(16(13)21)25-19(27)15-12(7-8-24-18(15)26)10-3-1-4-11(9-10)17(22)23;1-24-10-9-13(11-5-7-12(20)8-6-11)16(19(24)26)18(25)23-15-4-2-3-14(21)17(15)22;20-14-6-1-2-7-15(14)24-19(26)16-13(8-9-23-18(16)25)11-4-3-5-12(10-11)17(21)22;19-11-4-1-3-10(9-11)12-7-8-22-17(24)15(12)18(25)23-14-6-2-5-13(20)16(14)21/h2-8,11,14,17H,9-10H2,1H3,(H,25,27);1-5,8,11,14,17H,6-7H2,(H,25,27)(H,26,28);1-6,9,12,15,17H,7-8H2,(H,24,26)(H,25,27);2-8,13,16H,9-10H2,1H3,(H,23,25);1-7,10,13,16-17H,8-9H2,(H,23,25)(H,24,26);1-6,9,12,15H,7-8H2,(H,22,24)(H,23,25)/t;;;13?,16-;;12-,15-/m...0.1/s1.

What are the key properties of (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide?

(3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide has a molecular weight of 2278.52 g/mol, XLogP of 21.99, 22 rotatable bonds, 10 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for (3R,4S)-4-(3-chlorophenyl)-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2,3-difluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-N-(2-fluorophenyl)-2-oxopiperidine-3-carboxamide;4-[3-(difluoromethyl)phenyl]-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide;(3S)-N-(2,3-difluorophenyl)-4-(4-fluorophenyl)-1-methyl-2-oxopiperidine-3-carboxamide;N-(2-fluorophenyl)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 165019915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).