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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide

C95H84F16N10O10 — CID 157240963

IUPAC4-[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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide
SMILESCN1CCC(c2ccc(F)cc2)[C@@H](C(=O)Nc2cccc(F)c2F)C1=O.Cc1ccccc1NC(=O)[C@H]1C(=O)NCCC1c1ccc(F)cc1.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
InChIInChI=1S/C19H15F5N2O2.C19H16F4N2O2.2C19H17F3N2O2.C19H19FN2O2/c20-12-4-5-13(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;1-12-4-2-3-5-16(12)22-19(24)17-15(10-11-21-18(17)23)13-6-8-14(20)9-7-13/h1-5,8,11,14,17H,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);2-9,15,17H,10-11H2,1H3,(H,21,23)(H,22,24)/t;;13?,16-;;15?,17-/m..0.1/s1
InChIKeyAVFBXBRLQJYUDO-AFXRHPRWSA-N
MW1829.74 g/mol
LogP17.58
Rot. Bonds18

About 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide (PubChem CID 157240963) has the molecular formula C95H84F16N10O10 and a molecular weight of 1829.74 g/mol. Its IUPAC name is 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide.

Molecular Properties

Compound Name4-[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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide
PubChem CID157240963
Molecular FormulaC95H84F16N10O10
Molecular Weight1829.74 g/mol
Exact Mass1828.61
IUPAC Name4-[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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide
SMILESCN1CCC(c2ccc(F)cc2)[C@@H](C(=O)Nc2cccc(F)c2F)C1=O.Cc1ccccc1NC(=O)[C@H]1C(=O)NCCC1c1ccc(F)cc1.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
InChIInChI=1S/C19H15F5N2O2.C19H16F4N2O2.2C19H17F3N2O2.C19H19FN2O2/c20-12-4-5-13(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;1-12-4-2-3-5-16(12)22-19(24)17-15(10-11-21-18(17)23)13-6-8-14(20)9-7-13/h1-5,8,11,14,17H,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);2-9,15,17H,10-11H2,1H3,(H,21,23)(H,22,24)/t;;13?,16-;;15?,17-/m..0.1/s1
InChIKeyAVFBXBRLQJYUDO-AFXRHPRWSA-N
XLogP17.58
TPSA282.21 Ų
H-Bond Donors9
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001829.74
LogP ≤ 517.58
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide with MolForge

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Related Compounds

(3R,4S)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide
CID 165061569
(3S,4S)-1-methyl-4-(4-methylphenyl)-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 134412121
N-(2,3-difluorophenyl)-4-(3-methylphenyl)-2-oxopiperidine-3-carboxamide
CID 158374692
(3S,4S)-1-methyl-2-oxo-4-[3-(trifluoromethoxy)phenyl]-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 134411737
N-(2-methylphenyl)-2-oxo-4-[4-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 142445131
[2-fluoro-5-[4-[(2-fluorophenyl)carbamoyl]-1-methyl-5-oxopyrrolidin-3-yl]phenyl]thallium
CID 163597452
(3S,4S)-1-methyl-2-oxo-4-[2-(trifluoromethyl)phenyl]-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 134411933
4-[3-[fluoro(phosphanyl)methyl]phenyl]-1-methyl-2-oxo-N-(2,3,4-trifluorophenyl)piperidine-3-carbohydrazide
CID 168968732
(3S,4S)-N-(2,3-difluorophenyl)-4-[(4-fluorophenyl)methyl]-2-oxopiperidine-3-carboxamide
CID 155163703
(3S,4S)-4-(4-chlorophenyl)-1-methyl-2-oxo-N-(2,3,4-trifluorophenyl)pyrrolidine-3-carboxamide
CID 134416121
N-(2,3-difluorophenyl)-4-(4-methoxy-3,5-dimethylphenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide
CID 134412548
(3R,4S)-N-(2,3-difluorophenyl)-4-(1-methylindol-6-yl)-2-oxopyrrolidine-3-carboxamide
CID 134412150

Frequently Asked Questions

What is the IUPAC name of 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide?
The IUPAC name of 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide (CID 157240963) is 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide.
What is the SMILES notation for 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide?
The canonical SMILES for 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide is CN1CCC(c2ccc(F)cc2)[C@@H](C(=O)Nc2cccc(F)c2F)C1=O.Cc1ccccc1NC(=O)[C@H]1C(=O)NCCC1c1ccc(F)cc1.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.
What is the InChIKey of 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide?
The InChIKey is AVFBXBRLQJYUDO-AFXRHPRWSA-N. The full InChI is InChI=1S/C19H15F5N2O2.C19H16F4N2O2.2C19H17F3N2O2.C19H19FN2O2/c20-12-4-5-13(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;1-12-4-2-3-5-16(12)22-19(24)17-15(10-11-21-18(17)23)13-6-8-14(20)9-7-13/h1-5,8,11,14,17H,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);2-9,15,17H,10-11H2,1H3,(H,21,23)(H,22,24)/t;;13?,16-;;15?,17-/m..0.1/s1.
What are the key properties of 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide has a molecular weight of 1829.74 g/mol, XLogP of 17.58, 18 rotatable bonds, 9 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 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;(3R)-4-(4-fluorophenyl)-N-(2-methylphenyl)-2-oxopiperidine-3-carboxamide is sourced from PubChem (CID 157240963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).