2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone

C183H189F3N22O22S — CID 167645597

About 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone

2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone (PubChem CID 167645597) has the molecular formula C183H189F3N22O22S and a molecular weight of 3137.72 g/mol. Its IUPAC name is 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone.

Molecular Properties

• Compound Name: 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone
• PubChem CID: 167645597
• Molecular Formula: C183H189F3N22O22S
• Molecular Weight: 3137.72 g/mol
• Exact Mass: 3135.40
• IUPAC Name: 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone
• SMILES: Cc1cnc2c(S(=O)(=O)N3CCCCC3C(=O)CNc3ccc(F)cc3)cccc2c1.O=C(CNc1ccc(F)cc1)C1CCCCN1.O=C(CNc1ccc(F)cc1)C1CCc2ccccc2N1.O=C(CNc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1.O=C(CNc1ccccc1)C1CCCCN1.O=C(CNc1ccccc1)C1CCc2ccccc2N1.O=C(CNc1ccccc1)C1CCc2ccccc2N1C(=O)OCc1ccccc1.O=C(Cc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1.O=C(Cc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1C(=O)OCc1ccccc1.O=C(NCc1ccccc1)C1CNc2ccccc21
• InChI: InChI=1S/C25H22N2O5.C25H24N2O3.C23H24FN3O3S.C17H17FN2O.C17H17N3O3.C17H16N2O3.C17H18N2O.C16H16N2O.C13H17FN2O.C13H18N2O/c28-24(16-18-10-13-21(14-11-18)27(30)31)23-15-12-20-8-4-5-9-22(20)26(23)25(29)32-17-19-6-2-1-3-7-19;28-24(17-26-21-12-5-2-6-13-21)23-16-15-20-11-7-8-14-22(20)27(23)25(29)30-18-19-9-3-1-4-10-19;1-16-13-17-5-4-7-22(23(17)26-14-16)31(29,30)27-12-3-2-6-20(27)21(28)15-25-19-10-8-18(24)9-11-19;18-13-6-8-14(9-7-13)19-11-17(21)16-10-5-12-3-1-2-4-15(12)20-16;21-17(11-18-13-6-8-14(9-7-13)20(22)23)16-10-5-12-3-1-2-4-15(12)19-16;20-17(11-12-5-8-14(9-6-12)19(21)22)16-10-7-13-3-1-2-4-15(13)18-16;20-17(12-18-14-7-2-1-3-8-14)16-11-10-13-6-4-5-9-15(13)19-16;19-16(18-10-12-6-2-1-3-7-12)14-11-17-15-9-5-4-8-13(14)15;14-10-4-6-11(7-5-10)16-9-13(17)12-3-1-2-8-15-12;16-13(12-8-4-5-9-14-12)10-15-11-6-2-1-3-7-11/h1-11,13-14,23H,12,15-17H2;1-14,23,26H,15-18H2;4-5,7-11,13-14,20,25H,2-3,6,12,15H2,1H3;1-4,6-9,16,19-20H,5,10-11H2;1-4,6-9,16,18-19H,5,10-11H2;1-6,8-9,16,18H,7,10-11H2;1-9,16,18-19H,10-12H2;1-9,14,17H,10-11H2,(H,18,19);4-7,12,15-16H,1-3,8-9H2;1-3,6-7,12,14-15H,4-5,8-10H2
• InChIKey: PVDLPYSAOLJLIO-UHFFFAOYSA-N
• XLogP: 32.33
• TPSA: 589.92 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 37
• Rotatable Bonds: 46
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3137.72
LogP ≤ 5	32.33
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone?

The IUPAC name of 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone (CID 167645597) is 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone.

What is the SMILES notation for 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone?

The canonical SMILES for 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone is Cc1cnc2c(S(=O)(=O)N3CCCCC3C(=O)CNc3ccc(F)cc3)cccc2c1.O=C(CNc1ccc(F)cc1)C1CCCCN1.O=C(CNc1ccc(F)cc1)C1CCc2ccccc2N1.O=C(CNc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1.O=C(CNc1ccccc1)C1CCCCN1.O=C(CNc1ccccc1)C1CCc2ccccc2N1.O=C(CNc1ccccc1)C1CCc2ccccc2N1C(=O)OCc1ccccc1.O=C(Cc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1.O=C(Cc1ccc([N+](=O)[O-])cc1)C1CCc2ccccc2N1C(=O)OCc1ccccc1.O=C(NCc1ccccc1)C1CNc2ccccc21.

What is the InChIKey of 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone?

The InChIKey is PVDLPYSAOLJLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O5.C25H24N2O3.C23H24FN3O3S.C17H17FN2O.C17H17N3O3.C17H16N2O3.C17H18N2O.C16H16N2O.C13H17FN2O.C13H18N2O/c28-24(16-18-10-13-21(14-11-18)27(30)31)23-15-12-20-8-4-5-9-22(20)26(23)25(29)32-17-19-6-2-1-3-7-19;28-24(17-26-21-12-5-2-6-13-21)23-16-15-20-11-7-8-14-22(20)27(23)25(29)30-18-19-9-3-1-4-10-19;1-16-13-17-5-4-7-22(23(17)26-14-16)31(29,30)27-12-3-2-6-20(27)21(28)15-25-19-10-8-18(24)9-11-19;18-13-6-8-14(9-7-13)19-11-17(21)16-10-5-12-3-1-2-4-15(12)20-16;21-17(11-18-13-6-8-14(9-7-13)20(22)23)16-10-5-12-3-1-2-4-15(12)19-16;20-17(11-12-5-8-14(9-6-12)19(21)22)16-10-7-13-3-1-2-4-15(13)18-16;20-17(12-18-14-7-2-1-3-8-14)16-11-10-13-6-4-5-9-15(13)19-16;19-16(18-10-12-6-2-1-3-7-12)14-11-17-15-9-5-4-8-13(14)15;14-10-4-6-11(7-5-10)16-9-13(17)12-3-1-2-8-15-12;16-13(12-8-4-5-9-14-12)10-15-11-6-2-1-3-7-11/h1-11,13-14,23H,12,15-17H2;1-14,23,26H,15-18H2;4-5,7-11,13-14,20,25H,2-3,6,12,15H2,1H3;1-4,6-9,16,19-20H,5,10-11H2;1-4,6-9,16,18-19H,5,10-11H2;1-6,8-9,16,18H,7,10-11H2;1-9,16,18-19H,10-12H2;1-9,14,17H,10-11H2,(H,18,19);4-7,12,15-16H,1-3,8-9H2;1-3,6-7,12,14-15H,4-5,8-10H2.

What are the key properties of 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone?

2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone has a molecular weight of 3137.72 g/mol, XLogP of 32.33, 46 rotatable bonds, 15 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 2-anilino-1-piperidin-2-ylethanone;2-anilino-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;benzyl 2-(2-anilinoacetyl)-3,4-dihydro-2H-quinoline-1-carboxylate;N-benzyl-2,3-dihydro-1H-indole-3-carboxamide;benzyl 2-[2-(4-nitrophenyl)acetyl]-3,4-dihydro-2H-quinoline-1-carboxylate;2-(4-fluoroanilino)-1-[1-(3-methylquinolin-8-yl)sulfonylpiperidin-2-yl]ethanone;2-(4-fluoroanilino)-1-piperidin-2-ylethanone;2-(4-fluoroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitroanilino)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone;2-(4-nitrophenyl)-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanone is sourced from PubChem (CID 167645597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).