5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one

C196H166ClN27O11 — CID 165070490

IUPAC5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
SMILESC#Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.C#Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.CC(=O)c1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.COc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.O=C1Cc2cc(-c3cncc(NCc4ccc(-c5ccccc5)cc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4Cl)c3)ccc2N1
InChIInChI=1S/C26H21N3O.C22H19N3O2.2C22H17N3O.C21H19N3O2.3C21H19N3O.C20H16ClN3O/c30-26-14-22-12-21(10-11-25(22)29-26)23-13-24(17-27-16-23)28-15-18-6-8-20(9-7-18)19-4-2-1-3-5-19;1-14(26)16-4-2-3-15(7-16)11-24-20-9-19(12-23-13-20)17-5-6-21-18(8-17)10-22(27)25-21;1-2-15-3-5-16(6-4-15)12-24-20-10-19(13-23-14-20)17-7-8-21-18(9-17)11-22(26)25-21;1-2-15-4-3-5-16(8-15)12-24-20-10-19(13-23-14-20)17-6-7-21-18(9-17)11-22(26)25-21;1-26-19-5-2-14(3-6-19)11-23-18-9-17(12-22-13-18)15-4-7-20-16(8-15)10-21(25)24-20;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;2*1-14-3-2-4-15(7-14)11-23-19-9-18(12-22-13-19)16-5-6-20-17(8-16)10-21(25)24-20;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/h1-13,16-17,28H,14-15H2,(H,29,30);2-9,12-13,24H,10-11H2,1H3,(H,25,27);2*1,3-10,13-14,24H,11-12H2,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);3*2-9,12-13,23H,10-11H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25)
InChIKeySRDKJEDXZVQAMU-UHFFFAOYSA-N
MW3111.11 g/mol
LogP38.12
Rot. Bonds39

About 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one

5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one (PubChem CID 165070490) has the molecular formula C196H166ClN27O11 and a molecular weight of 3111.11 g/mol. Its IUPAC name is 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
PubChem CID165070490
Molecular FormulaC196H166ClN27O11
Molecular Weight3111.11 g/mol
Exact Mass3108.29
IUPAC Name5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one
SMILESC#Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.C#Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.CC(=O)c1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.COc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.O=C1Cc2cc(-c3cncc(NCc4ccc(-c5ccccc5)cc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4Cl)c3)ccc2N1
InChIInChI=1S/C26H21N3O.C22H19N3O2.2C22H17N3O.C21H19N3O2.3C21H19N3O.C20H16ClN3O/c30-26-14-22-12-21(10-11-25(22)29-26)23-13-24(17-27-16-23)28-15-18-6-8-20(9-7-18)19-4-2-1-3-5-19;1-14(26)16-4-2-3-15(7-16)11-24-20-9-19(12-23-13-20)17-5-6-21-18(8-17)10-22(27)25-21;1-2-15-3-5-16(6-4-15)12-24-20-10-19(13-23-14-20)17-7-8-21-18(9-17)11-22(26)25-21;1-2-15-4-3-5-16(8-15)12-24-20-10-19(13-23-14-20)17-6-7-21-18(9-17)11-22(26)25-21;1-26-19-5-2-14(3-6-19)11-23-18-9-17(12-22-13-18)15-4-7-20-16(8-15)10-21(25)24-20;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;2*1-14-3-2-4-15(7-14)11-23-19-9-18(12-22-13-19)16-5-6-20-17(8-16)10-21(25)24-20;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/h1-13,16-17,28H,14-15H2,(H,29,30);2-9,12-13,24H,10-11H2,1H3,(H,25,27);2*1,3-10,13-14,24H,11-12H2,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);3*2-9,12-13,23H,10-11H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25)
InChIKeySRDKJEDXZVQAMU-UHFFFAOYSA-N
XLogP38.12
TPSA512.48 Ų
H-Bond Donors18
H-Bond Acceptors29
Rotatable Bonds39
Heavy Atoms235
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003111.11
LogP ≤ 538.12
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-[1-(3-Aminopropyl)-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]phenyl]ethanone;4-[1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]benzamide;[2-[1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]phenyl]methanol;1-butyl-4-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indole;3-[5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(3-propylphenyl)indol-1-yl]propan-1-amine
CID 157130055
1-[2-[1-(3-Aminopropyl)-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]-3-fluorophenyl]ethanone;4-[2-[1-(3-aminopropyl)-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]-5-(trifluoromethoxy)phenyl]butan-2-one;3-[5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[2-[(dimethylamino)methyl]-4-methoxyphenyl]indol-1-yl]propan-1-amine;3-[5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[2-propyl-4-(trifluoromethoxy)phenyl]indol-1-yl]propan-1-amine;3-[3-[2-ethyl-4-(trifluoromethoxy)phenyl]-5-[[4-[2-(3-methoxy-5-methylphenyl)propan-2-yl]piperazin-1-yl]methyl]indol-1-yl]propan-1-amine;3-[3-[2-ethyl-4-(trifluoromethoxy)phenyl]-5-[[4-[2-(3-methylphenyl)propan-2-yl]piperazin-1-yl]methyl]indol-1-yl]propan-1-amine
CID 158222180
CID 159007748
CID 159007748
5-[(benzylamino)methyl]-7-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-chloro-5-(4-pyridin-4-ylpiperazin-1-yl)-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;5-[(2,3-dihydro-1H-inden-2-ylamino)methyl]-7-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[(2-phenylethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[(3-phenylpropylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[(pyridin-3-ylmethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[(pyridin-4-ylmethylamino)methyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one
CID 160216184
5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-7-chloro-2-[(4-chlorophenyl)methyl]-3H-isoindol-1-one;5-(4-benzylpiperazine-1-carbonyl)-7-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-chloro-2-[(4-chlorophenyl)methyl]-5-[3-(dimethylamino)pyrrolidin-1-yl]-3H-isoindol-1-one;7-chloro-2-[(4-chlorophenyl)methyl]-5-(4-methylpiperazin-1-yl)-3H-isoindol-1-one;5-chloro-2-[(4-ethylphenyl)methyl]-7-(trifluoromethyl)-3H-isoindol-1-one;7-chloro-5-(1,2,3,6-tetrahydropyridin-4-yl)-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one;7-methyl-5-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one
CID 160456748
1-[3-[1-(3-Aminopropyl)-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]phenyl]ethanone;4-[1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]benzamide;[2-[1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]indol-3-yl]phenyl]methanol;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(3-propylphenyl)indole;1-butyl-4-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indole
CID 161980053
2-[5-[[6-chloro-5-[4-(2-hydroxyphenyl)phenyl]-2-oxo-1H-pyrrolo[3,2-b]pyridin-3-ylidene]methyl]-2-methylphenyl]acetic acid;2-[5-[[6-chloro-5-[5-(2-hydroxyphenyl)-2-pyridinyl]-2-oxo-1H-indol-3-ylidene]methyl]-2-methoxyphenyl]acetic acid;5-[[6-chloro-5-[5-(2-hydroxyphenyl)-2-pyridinyl]-2-oxo-1H-indol-3-ylidene]methyl]-2-methylbenzoic acid;2-[5-[[6-chloro-5-[6-(2-hydroxyphenyl)-3-pyridinyl]-2-oxo-1H-indol-3-ylidene]methyl]-2-methylphenyl]acetic acid;2-[3-[[6-chloro-5-[6-(2-hydroxyphenyl)-3-pyridinyl]-2-oxo-1H-indol-3-ylidene]methyl]phenyl]acetic acid
CID 160104667
9-Amino-1-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]nonan-2-one;bis(9-[bis(pyridin-2-ylmethyl)amino]-1-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]nonan-2-one);methane;methanone;2-methoxypyridine;rhenium;trihydrate
CID 161176897
N-[[1-[2-(2-chlorophenyl)ethyl]piperidin-3-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methyl]-1H-indole-2-carboxamide;bis(N-ethyl-N-[[1-[2-(3-methylphenyl)ethyl]piperidin-3-yl]methyl]-1H-indole-2-carboxamide);N-ethyl-N-[[1-[(4-methylphenyl)methyl]piperidin-3-yl]methyl]-1H-indole-2-carboxamide
CID 161926912
N-(6-aminohexyl)-2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]acetamide;bis(N-[6-[bis(pyridin-2-ylmethyl)amino]hexyl]-2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]acetamide);methanone;2-methoxypyridine;rhenium;trihydrate
CID 164134513
6-[5-[(2-Chloroanilino)methyl]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(2-fluoroanilino)methyl]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(2-methoxyanilino)methyl]-3-pyridinyl]-1,3-dihydroindol-2-one;6-[5-[(3-methylanilino)methyl]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(6-[5-[(4-methylanilino)methyl]-3-pyridinyl]-1,3-dihydroindol-2-one)
CID 165051052

Frequently Asked Questions

What is the IUPAC name of 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The IUPAC name of 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one (CID 165070490) is 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The canonical SMILES for 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one is C#Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.C#Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.CC(=O)c1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.COc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1ccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)cc1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.Cc1cccc(CNc2cncc(-c3ccc4c(c3)CC(=O)N4)c2)c1.O=C1Cc2cc(-c3cncc(NCc4ccc(-c5ccccc5)cc4)c3)ccc2N1.O=C1Cc2cc(-c3cncc(NCc4ccccc4Cl)c3)ccc2N1.
What is the InChIKey of 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
The InChIKey is SRDKJEDXZVQAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N3O.C22H19N3O2.2C22H17N3O.C21H19N3O2.3C21H19N3O.C20H16ClN3O/c30-26-14-22-12-21(10-11-25(22)29-26)23-13-24(17-27-16-23)28-15-18-6-8-20(9-7-18)19-4-2-1-3-5-19;1-14(26)16-4-2-3-15(7-16)11-24-20-9-19(12-23-13-20)17-5-6-21-18(8-17)10-22(27)25-21;1-2-15-3-5-16(6-4-15)12-24-20-10-19(13-23-14-20)17-7-8-21-18(9-17)11-22(26)25-21;1-2-15-4-3-5-16(8-15)12-24-20-10-19(13-23-14-20)17-6-7-21-18(9-17)11-22(26)25-21;1-26-19-5-2-14(3-6-19)11-23-18-9-17(12-22-13-18)15-4-7-20-16(8-15)10-21(25)24-20;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;2*1-14-3-2-4-15(7-14)11-23-19-9-18(12-22-13-19)16-5-6-20-17(8-16)10-21(25)24-20;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/h1-13,16-17,28H,14-15H2,(H,29,30);2-9,12-13,24H,10-11H2,1H3,(H,25,27);2*1,3-10,13-14,24H,11-12H2,(H,25,26);2-9,12-13,23H,10-11H2,1H3,(H,24,25);3*2-9,12-13,23H,10-11H2,1H3,(H,24,25);1-8,10,12,23H,9,11H2,(H,24,25).
What are the key properties of 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one?
5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one has a molecular weight of 3111.11 g/mol, XLogP of 38.12, 39 rotatable bonds, 18 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-[(3-acetylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(2-chlorophenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(3-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-ethynylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-methoxyphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;bis(5-[5-[(3-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one);5-[5-[(4-methylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one;5-[5-[(4-phenylphenyl)methylamino]-3-pyridinyl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 165070490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).