4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one

C176H232ClFN35O3S+11 — CID 172985063

IUPAC4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one
SMILESC.C.C.C.C.C.C.C.C.C.C.CN(N=Cc1cc[n+](C)c(=O)n1C)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccc(Cl)cc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1F.CN(N=Cc1cccc[n+]1C)c1ccccc1.CN(N=Cc1sc2ccccc2[n+]1C)c1ccccc1.COc1ccc(N(C)/N=C/c2cc[n+](C)cc2)cc1.C[n+]1ccc(C=NN2CCc3ccccc32)cc1.C[n+]1ccc(C=NN2c3ccccc3C(C)(C)C2(C)C)cc1.C[n+]1ccccc1C=NN1CCc2ccccc21.Cc1cc(C=NN(C)c2ccccc2)[n+](C)c(=O)n1C
InChIInChI=1S/C19H24N3.C16H16N3S.C15H19N4O.C15H18N3O.2C15H16N3.C14H15ClN3.C14H15FN3.C14H17N4O.2C14H16N3.11CH4/c1-18(2)16-8-6-7-9-17(16)22(19(18,3)4)20-14-15-10-12-21(5)13-11-15;1-18-14-10-6-7-11-15(14)20-16(18)12-17-19(2)13-8-4-3-5-9-13;1-12-10-14(18(3)15(20)17(12)2)11-16-19(4)13-8-6-5-7-9-13;1-17-10-8-13(9-11-17)12-16-18(2)14-4-6-15(19-3)7-5-14;1-17-10-5-4-7-14(17)12-16-18-11-9-13-6-2-3-8-15(13)18;1-17-9-6-13(7-10-17)12-16-18-11-8-14-4-2-3-5-15(14)18;1-17-9-7-12(8-10-17)11-16-18(2)14-5-3-13(15)4-6-14;1-17-9-7-12(8-10-17)11-16-18(2)14-6-4-3-5-13(14)15;1-16-10-9-13(17(2)14(16)19)11-15-18(3)12-7-5-4-6-8-12;1-16-11-7-6-10-14(16)12-15-17(2)13-8-4-3-5-9-13;1-16-10-8-13(9-11-16)12-15-17(2)14-6-4-3-5-7-14;;;;;;;;;;;/h6-14H,1-5H3;3-12H,1-2H3;5-11H,1-4H3;4-12H,1-3H3;2-8,10,12H,9,11H2,1H3;2-7,9-10,12H,8,11H2,1H3;2*3-11H,1-2H3;4-11H,1-3H3;2*3-12H,1-2H3;11*1H4/q11*+1;;;;;;;;;;;
InChIKeyHODQOYIIYLZYAR-UHFFFAOYSA-N
MW2972.55 g/mol
LogP29.81
Rot. Bonds31

About 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one

4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one (PubChem CID 172985063) has the molecular formula C176H232ClFN35O3S+11 and a molecular weight of 2972.55 g/mol. Its IUPAC name is 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one.

Molecular Properties

Compound Name4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one
PubChem CID172985063
Molecular FormulaC176H232ClFN35O3S+11
Molecular Weight2972.55 g/mol
Exact Mass2969.84
IUPAC Name4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one
SMILESC.C.C.C.C.C.C.C.C.C.C.CN(N=Cc1cc[n+](C)c(=O)n1C)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccc(Cl)cc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1F.CN(N=Cc1cccc[n+]1C)c1ccccc1.CN(N=Cc1sc2ccccc2[n+]1C)c1ccccc1.COc1ccc(N(C)/N=C/c2cc[n+](C)cc2)cc1.C[n+]1ccc(C=NN2CCc3ccccc32)cc1.C[n+]1ccc(C=NN2c3ccccc3C(C)(C)C2(C)C)cc1.C[n+]1ccccc1C=NN1CCc2ccccc21.Cc1cc(C=NN(C)c2ccccc2)[n+](C)c(=O)n1C
InChIInChI=1S/C19H24N3.C16H16N3S.C15H19N4O.C15H18N3O.2C15H16N3.C14H15ClN3.C14H15FN3.C14H17N4O.2C14H16N3.11CH4/c1-18(2)16-8-6-7-9-17(16)22(19(18,3)4)20-14-15-10-12-21(5)13-11-15;1-18-14-10-6-7-11-15(14)20-16(18)12-17-19(2)13-8-4-3-5-9-13;1-12-10-14(18(3)15(20)17(12)2)11-16-19(4)13-8-6-5-7-9-13;1-17-10-8-13(9-11-17)12-16-18(2)14-4-6-15(19-3)7-5-14;1-17-10-5-4-7-14(17)12-16-18-11-9-13-6-2-3-8-15(13)18;1-17-9-6-13(7-10-17)12-16-18-11-8-14-4-2-3-5-15(14)18;1-17-9-7-12(8-10-17)11-16-18(2)14-5-3-13(15)4-6-14;1-17-9-7-12(8-10-17)11-16-18(2)14-6-4-3-5-13(14)15;1-16-10-9-13(17(2)14(16)19)11-15-18(3)12-7-5-4-6-8-12;1-16-11-7-6-10-14(16)12-15-17(2)13-8-4-3-5-9-13;1-16-10-8-13(9-11-16)12-15-17(2)14-6-4-3-5-7-14;;;;;;;;;;;/h6-14H,1-5H3;3-12H,1-2H3;5-11H,1-4H3;4-12H,1-3H3;2-8,10,12H,9,11H2,1H3;2-7,9-10,12H,8,11H2,1H3;2*3-11H,1-2H3;4-11H,1-3H3;2*3-12H,1-2H3;11*1H4/q11*+1;;;;;;;;;;;
InChIKeyHODQOYIIYLZYAR-UHFFFAOYSA-N
XLogP29.81
TPSA267.51 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds31
Heavy Atoms217
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002972.55
LogP ≤ 529.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one?
The IUPAC name of 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one (CID 172985063) is 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one.
What is the SMILES notation for 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one?
The canonical SMILES for 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one is C.C.C.C.C.C.C.C.C.C.C.CN(N=Cc1cc[n+](C)c(=O)n1C)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccc(Cl)cc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1.CN(N=Cc1cc[n+](C)cc1)c1ccccc1F.CN(N=Cc1cccc[n+]1C)c1ccccc1.CN(N=Cc1sc2ccccc2[n+]1C)c1ccccc1.COc1ccc(N(C)/N=C/c2cc[n+](C)cc2)cc1.C[n+]1ccc(C=NN2CCc3ccccc32)cc1.C[n+]1ccc(C=NN2c3ccccc3C(C)(C)C2(C)C)cc1.C[n+]1ccccc1C=NN1CCc2ccccc21.Cc1cc(C=NN(C)c2ccccc2)[n+](C)c(=O)n1C.
What is the InChIKey of 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one?
The InChIKey is HODQOYIIYLZYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N3.C16H16N3S.C15H19N4O.C15H18N3O.2C15H16N3.C14H15ClN3.C14H15FN3.C14H17N4O.2C14H16N3.11CH4/c1-18(2)16-8-6-7-9-17(16)22(19(18,3)4)20-14-15-10-12-21(5)13-11-15;1-18-14-10-6-7-11-15(14)20-16(18)12-17-19(2)13-8-4-3-5-9-13;1-12-10-14(18(3)15(20)17(12)2)11-16-19(4)13-8-6-5-7-9-13;1-17-10-8-13(9-11-17)12-16-18(2)14-4-6-15(19-3)7-5-14;1-17-10-5-4-7-14(17)12-16-18-11-9-13-6-2-3-8-15(13)18;1-17-9-6-13(7-10-17)12-16-18-11-8-14-4-2-3-5-15(14)18;1-17-9-7-12(8-10-17)11-16-18(2)14-5-3-13(15)4-6-14;1-17-9-7-12(8-10-17)11-16-18(2)14-6-4-3-5-13(14)15;1-16-10-9-13(17(2)14(16)19)11-15-18(3)12-7-5-4-6-8-12;1-16-11-7-6-10-14(16)12-15-17(2)13-8-4-3-5-9-13;1-16-10-8-13(9-11-16)12-15-17(2)14-6-4-3-5-7-14;;;;;;;;;;;/h6-14H,1-5H3;3-12H,1-2H3;5-11H,1-4H3;4-12H,1-3H3;2-8,10,12H,9,11H2,1H3;2-7,9-10,12H,8,11H2,1H3;2*3-11H,1-2H3;4-11H,1-3H3;2*3-12H,1-2H3;11*1H4/q11*+1;;;;;;;;;;;.
What are the key properties of 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one?
4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one has a molecular weight of 2972.55 g/mol, XLogP of 29.81, 31 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-2-yl)methanimine;N-(2,3-dihydroindol-1-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine;1,3-dimethyl-4-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one;2-fluoro-N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;methane;4-methoxy-N-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;N-methyl-N-[(3-methyl-1,3-benzothiazol-3-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-2-yl)methylideneamino]aniline;N-methyl-N-[(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline;1-(1-methylpyridin-1-ium-4-yl)-N-(2,2,3,3-tetramethylindol-1-yl)methanimine;1,3,4-trimethyl-6-[[methyl(phenyl)hydrazinylidene]methyl]pyrimidin-1-ium-2-one is sourced from PubChem (CID 172985063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).