4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one

C149H176ClF2N30O18S- — CID 161485687

IUPAC4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one
SMILESCN(C1CCCCC1)C1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CS(=O)[O-].Cn1cc(C(=O)N2CCC(C(C)(C)C)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(CCN)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(F)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cccc(F)c3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cnccn3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(n3cnc4ccccc43)CC2)c2cc[nH]c2c1=O
InChIInChI=1S/C21H21N5O2.C21H30N4O2.C20H20ClN3O2.C20H20FN3O2.C18H19N5O2.C18H25N3O2.C16H22N4O2.C14H16FN3O2.CH4O2S/c1-24-12-16(15-6-9-22-19(15)21(24)28)20(27)25-10-7-14(8-11-25)26-13-23-17-4-2-3-5-18(17)26;1-23-14-18(17-8-11-22-19(17)21(23)27)20(26)25-12-9-16(10-13-25)24(2)15-6-4-3-5-7-15;1-23-12-17(16-6-9-22-18(16)20(23)26)19(25)24-10-7-14(8-11-24)13-2-4-15(21)5-3-13;1-23-12-17(16-5-8-22-18(16)20(23)26)19(25)24-9-6-13(7-10-24)14-3-2-4-15(21)11-14;1-22-11-14(13-2-5-21-16(13)18(22)25)17(24)23-8-3-12(4-9-23)15-10-19-6-7-20-15;1-18(2,3)12-6-9-21(10-7-12)16(22)14-11-20(4)17(23)15-13(14)5-8-19-15;1-19-10-13(12-3-7-18-14(12)16(19)22)15(21)20-8-4-11(2-6-17)5-9-20;1-17-8-11(10-2-5-16-12(10)14(17)20)13(19)18-6-3-9(15)4-7-18;1-4(2)3/h2-6,9,12-14,22H,7-8,10-11H2,1H3;8,11,14-16,22H,3-7,9-10,12-13H2,1-2H3;2-6,9,12,14,22H,7-8,10-11H2,1H3;2-5,8,11-13,22H,6-7,9-10H2,1H3;2,5-7,10-12,21H,3-4,8-9H2,1H3;5,8,11-12,19H,6-7,9-10H2,1-4H3;3,7,10-11,18H,2,4-6,8-9,17H2,1H3;2,5,8-9,16H,3-4,6-7H2,1H3;1H3,(H,2,3)/p-1
InChIKeyIHEGFISMGBTHSV-UHFFFAOYSA-M
MW2780.75 g/mol
LogP18.44
Rot. Bonds16

About 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one

4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one (PubChem CID 161485687) has the molecular formula C149H176ClF2N30O18S- and a molecular weight of 2780.75 g/mol. Its IUPAC name is 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one
PubChem CID161485687
Molecular FormulaC149H176ClF2N30O18S-
Molecular Weight2780.75 g/mol
Exact Mass2778.32
IUPAC Name4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one
SMILESCN(C1CCCCC1)C1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CS(=O)[O-].Cn1cc(C(=O)N2CCC(C(C)(C)C)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(CCN)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(F)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cccc(F)c3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cnccn3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(n3cnc4ccccc43)CC2)c2cc[nH]c2c1=O
InChIInChI=1S/C21H21N5O2.C21H30N4O2.C20H20ClN3O2.C20H20FN3O2.C18H19N5O2.C18H25N3O2.C16H22N4O2.C14H16FN3O2.CH4O2S/c1-24-12-16(15-6-9-22-19(15)21(24)28)20(27)25-10-7-14(8-11-25)26-13-23-17-4-2-3-5-18(17)26;1-23-14-18(17-8-11-22-19(17)21(23)27)20(26)25-12-9-16(10-13-25)24(2)15-6-4-3-5-7-15;1-23-12-17(16-6-9-22-18(16)20(23)26)19(25)24-10-7-14(8-11-24)13-2-4-15(21)5-3-13;1-23-12-17(16-5-8-22-18(16)20(23)26)19(25)24-9-6-13(7-10-24)14-3-2-4-15(21)11-14;1-22-11-14(13-2-5-21-16(13)18(22)25)17(24)23-8-3-12(4-9-23)15-10-19-6-7-20-15;1-18(2,3)12-6-9-21(10-7-12)16(22)14-11-20(4)17(23)15-13(14)5-8-19-15;1-19-10-13(12-3-7-18-14(12)16(19)22)15(21)20-8-4-11(2-6-17)5-9-20;1-17-8-11(10-2-5-16-12(10)14(17)20)13(19)18-6-3-9(15)4-7-18;1-4(2)3/h2-6,9,12-14,22H,7-8,10-11H2,1H3;8,11,14-16,22H,3-7,9-10,12-13H2,1-2H3;2-6,9,12,14,22H,7-8,10-11H2,1H3;2-5,8,11-13,22H,6-7,9-10H2,1H3;2,5-7,10-12,21H,3-4,8-9H2,1H3;5,8,11-12,19H,6-7,9-10H2,1-4H3;3,7,10-11,18H,2,4-6,8-9,17H2,1H3;2,5,8-9,16H,3-4,6-7H2,1H3;1H3,(H,2,3)/p-1
InChIKeyIHEGFISMGBTHSV-UHFFFAOYSA-M
XLogP18.44
TPSA577.79 Ų
H-Bond Donors9
H-Bond Acceptors32
Rotatable Bonds16
Heavy Atoms201
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002780.75
LogP ≤ 518.44
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

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

Analyze 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one (CID 161485687) is 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one is CN(C1CCCCC1)C1CCN(C(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1.CS(=O)[O-].Cn1cc(C(=O)N2CCC(C(C)(C)C)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(CCN)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(F)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cccc(F)c3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(c3cnccn3)CC2)c2cc[nH]c2c1=O.Cn1cc(C(=O)N2CCC(n3cnc4ccccc43)CC2)c2cc[nH]c2c1=O.
What is the InChIKey of 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one?
The InChIKey is IHEGFISMGBTHSV-UHFFFAOYSA-M. The full InChI is InChI=1S/C21H21N5O2.C21H30N4O2.C20H20ClN3O2.C20H20FN3O2.C18H19N5O2.C18H25N3O2.C16H22N4O2.C14H16FN3O2.CH4O2S/c1-24-12-16(15-6-9-22-19(15)21(24)28)20(27)25-10-7-14(8-11-25)26-13-23-17-4-2-3-5-18(17)26;1-23-14-18(17-8-11-22-19(17)21(23)27)20(26)25-12-9-16(10-13-25)24(2)15-6-4-3-5-7-15;1-23-12-17(16-6-9-22-18(16)20(23)26)19(25)24-10-7-14(8-11-24)13-2-4-15(21)5-3-13;1-23-12-17(16-5-8-22-18(16)20(23)26)19(25)24-9-6-13(7-10-24)14-3-2-4-15(21)11-14;1-22-11-14(13-2-5-21-16(13)18(22)25)17(24)23-8-3-12(4-9-23)15-10-19-6-7-20-15;1-18(2,3)12-6-9-21(10-7-12)16(22)14-11-20(4)17(23)15-13(14)5-8-19-15;1-19-10-13(12-3-7-18-14(12)16(19)22)15(21)20-8-4-11(2-6-17)5-9-20;1-17-8-11(10-2-5-16-12(10)14(17)20)13(19)18-6-3-9(15)4-7-18;1-4(2)3/h2-6,9,12-14,22H,7-8,10-11H2,1H3;8,11,14-16,22H,3-7,9-10,12-13H2,1-2H3;2-6,9,12,14,22H,7-8,10-11H2,1H3;2-5,8,11-13,22H,6-7,9-10H2,1H3;2,5-7,10-12,21H,3-4,8-9H2,1H3;5,8,11-12,19H,6-7,9-10H2,1-4H3;3,7,10-11,18H,2,4-6,8-9,17H2,1H3;2,5,8-9,16H,3-4,6-7H2,1H3;1H3,(H,2,3)/p-1.
What are the key properties of 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one?
4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one has a molecular weight of 2780.75 g/mol, XLogP of 18.44, 16 rotatable bonds, 9 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-aminoethyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(benzimidazol-1-yl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-tert-butylpiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(4-chlorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-[cyclohexyl(methyl)amino]piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-[4-(3-fluorophenyl)piperidine-1-carbonyl]-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;4-(4-fluoropiperidine-1-carbonyl)-6-methyl-1H-pyrrolo[2,3-c]pyridin-7-one;methanesulfinate;6-methyl-4-(4-pyrazin-2-ylpiperidine-1-carbonyl)-1H-pyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 161485687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).