5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one

C166H147FN24O8 — CID 164966618

IUPAC5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
SMILESCc1ccc(CNc2cc(-c3ccc4c(c3)CC(=O)N4)cnc2C)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)cn2)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)nc2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ncc(-c2ccc3c(c2)CC(=O)N3)cc1NCc1ccccc1.O=C1Cc2cc(-c3cncc(NCc4ccccc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4F)c3)ccc2N1.O=C1Cc2ccc(-c3ccc(NCc4ccccc4)nc3)cc2N1
InChIInChI=1S/C22H21N3O.4C21H19N3O.C20H16FN3O.2C20H17N3O/c1-14-3-5-16(6-4-14)12-24-21-10-19(13-23-15(21)2)17-7-8-20-18(9-17)11-22(26)25-20;1-14-2-4-15(5-3-14)11-23-19-9-18(12-22-13-19)16-6-7-20-17(8-16)10-21(25)24-20;1-14-2-4-15(5-3-14)12-22-18-8-9-19(23-13-18)16-6-7-17-11-21(25)24-20(17)10-16;1-14-2-4-15(5-3-14)12-22-20-9-8-18(13-23-20)16-6-7-17-11-21(25)24-19(17)10-16;1-14-20(23-12-15-5-3-2-4-6-15)10-18(13-22-14)16-7-8-19-17(9-16)11-21(25)24-19;21-18-4-2-1-3-14(18)11-23-17-8-16(10-22-12-17)13-5-6-19-15(7-13)9-20(25)24-19;24-20-10-16-8-15(6-7-19(16)23-20)17-9-18(13-21-12-17)22-11-14-4-2-1-3-5-14;24-20-11-16-7-6-15(10-18(16)23-20)17-8-9-19(22-13-17)21-12-14-4-2-1-3-5-14/h3-10,13,24H,11-12H2,1-2H3,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);2-10,13,22H,11-12H2,1H3,(H,24,25);2-10,13H,11-12H2,1H3,(H,22,23)(H,24,25);2-10,13,23H,11-12H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25);1-9,12-13,22H,10-11H2,(H,23,24);1-10,13H,11-12H2,(H,21,22)(H,23,24)
InChIKeyCOJSQNAMFHVJDP-UHFFFAOYSA-N
MW2625.16 g/mol
LogP32.83
Rot. Bonds32

About 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one

5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one (PubChem CID 164966618) has the molecular formula C166H147FN24O8 and a molecular weight of 2625.16 g/mol. Its IUPAC name is 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
PubChem CID164966618
Molecular FormulaC166H147FN24O8
Molecular Weight2625.16 g/mol
Exact Mass2623.18
IUPAC Name5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
SMILESCc1ccc(CNc2cc(-c3ccc4c(c3)CC(=O)N4)cnc2C)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)cn2)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)nc2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ncc(-c2ccc3c(c2)CC(=O)N3)cc1NCc1ccccc1.O=C1Cc2cc(-c3cncc(NCc4ccccc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4F)c3)ccc2N1.O=C1Cc2ccc(-c3ccc(NCc4ccccc4)nc3)cc2N1
InChIInChI=1S/C22H21N3O.4C21H19N3O.C20H16FN3O.2C20H17N3O/c1-14-3-5-16(6-4-14)12-24-21-10-19(13-23-15(21)2)17-7-8-20-18(9-17)11-22(26)25-20;1-14-2-4-15(5-3-14)11-23-19-9-18(12-22-13-19)16-6-7-20-17(8-16)10-21(25)24-20;1-14-2-4-15(5-3-14)12-22-18-8-9-19(23-13-18)16-6-7-17-11-21(25)24-20(17)10-16;1-14-2-4-15(5-3-14)12-22-20-9-8-18(13-23-20)16-6-7-17-11-21(25)24-19(17)10-16;1-14-20(23-12-15-5-3-2-4-6-15)10-18(13-22-14)16-7-8-19-17(9-16)11-21(25)24-19;21-18-4-2-1-3-14(18)11-23-17-8-16(10-22-12-17)13-5-6-19-15(7-13)9-20(25)24-19;24-20-10-16-8-15(6-7-19(16)23-20)17-9-18(13-21-12-17)22-11-14-4-2-1-3-5-14;24-20-11-16-7-6-15(10-18(16)23-20)17-8-9-19(22-13-17)21-12-14-4-2-1-3-5-14/h3-10,13,24H,11-12H2,1-2H3,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);2-10,13,22H,11-12H2,1H3,(H,24,25);2-10,13H,11-12H2,1H3,(H,22,23)(H,24,25);2-10,13,23H,11-12H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25);1-9,12-13,22H,10-11H2,(H,23,24);1-10,13H,11-12H2,(H,21,22)(H,23,24)
InChIKeyCOJSQNAMFHVJDP-UHFFFAOYSA-N
XLogP32.83
TPSA432.16 Ų
H-Bond Donors16
H-Bond Acceptors24
Rotatable Bonds32
Heavy Atoms199
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002625.16
LogP ≤ 532.83
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1024

Analyze 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The IUPAC name of 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one (CID 164966618) is 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The canonical SMILES for 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one is Cc1ccc(CNc2cc(-c3ccc4c(c3)CC(=O)N4)cnc2C)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)cn2)cc1.Cc1ccc(CNc2ccc(-c3ccc4c(c3)NC(=O)C4)nc2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ncc(-c2ccc3c(c2)CC(=O)N3)cc1NCc1ccccc1.O=C1Cc2cc(-c3cncc(NCc4ccccc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4F)c3)ccc2N1.O=C1Cc2ccc(-c3ccc(NCc4ccccc4)nc3)cc2N1.
What is the InChIKey of 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The InChIKey is COJSQNAMFHVJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O.4C21H19N3O.C20H16FN3O.2C20H17N3O/c1-14-3-5-16(6-4-14)12-24-21-10-19(13-23-15(21)2)17-7-8-20-18(9-17)11-22(26)25-20;1-14-2-4-15(5-3-14)11-23-19-9-18(12-22-13-19)16-6-7-20-17(8-16)10-21(25)24-20;1-14-2-4-15(5-3-14)12-22-18-8-9-19(23-13-18)16-6-7-17-11-21(25)24-20(17)10-16;1-14-2-4-15(5-3-14)12-22-20-9-8-18(13-23-20)16-6-7-17-11-21(25)24-19(17)10-16;1-14-20(23-12-15-5-3-2-4-6-15)10-18(13-22-14)16-7-8-19-17(9-16)11-21(25)24-19;21-18-4-2-1-3-14(18)11-23-17-8-16(10-22-12-17)13-5-6-19-15(7-13)9-20(25)24-19;24-20-10-16-8-15(6-7-19(16)23-20)17-9-18(13-21-12-17)22-11-14-4-2-1-3-5-14;24-20-11-16-7-6-15(10-18(16)23-20)17-8-9-19(22-13-17)21-12-14-4-2-1-3-5-14/h3-10,13,24H,11-12H2,1-2H3,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);2-10,13,22H,11-12H2,1H3,(H,24,25);2-10,13H,11-12H2,1H3,(H,22,23)(H,24,25);2-10,13,23H,11-12H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25);1-9,12-13,22H,10-11H2,(H,23,24);1-10,13H,11-12H2,(H,21,22)(H,23,24).
What are the key properties of 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one has a molecular weight of 2625.16 g/mol, XLogP of 32.83, 32 rotatable bonds, 16 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(benzylamino)-6-methyl-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;6-[6-(benzylamino)-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-fluorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[6-methyl-5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(4-methylphenyl)methylamino]-2-pyridinyl]-1,3-dihydroindol-2-one;6-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 164966618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).