N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine

C116H104N16O10 — CID 158213071

IUPACN-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine
SMILESC/C(=N\c1ccc([N+](=O)[O-])cc1C)c1cccc(/C(C)=N/c2ccc([N+](=O)[O-])cc2C)n1.COc1ccc(/N=C(\C)c2cccc(/C(C)=N/c3ccc(C)cc3C)n2)c(C)c1.COc1ccc(/N=C(\c2ccccc2)c2cccc(/C(=N/c3ccc(C)cc3C)c3ccccc3)n2)c(C)c1.Cc1cc([N+](=O)[O-])ccc1/N=C(\c1ccccc1)c1cccc(/C(=N/c2ccc([N+](=O)[O-])cc2C)c2ccccc2)n1
InChIInChI=1S/C35H31N3O.C33H25N5O4.C25H27N3O.C23H21N5O4/c1-24-18-20-30(25(2)22-24)37-34(27-12-7-5-8-13-27)32-16-11-17-33(36-32)35(28-14-9-6-10-15-28)38-31-21-19-29(39-4)23-26(31)3;1-22-20-26(37(39)40)16-18-28(22)35-32(24-10-5-3-6-11-24)30-14-9-15-31(34-30)33(25-12-7-4-8-13-25)36-29-19-17-27(38(41)42)21-23(29)2;1-16-10-12-22(17(2)14-16)26-19(4)24-8-7-9-25(28-24)20(5)27-23-13-11-21(29-6)15-18(23)3;1-14-12-18(27(29)30)8-10-20(14)24-16(3)22-6-5-7-23(26-22)17(4)25-21-11-9-19(28(31)32)13-15(21)2/h5-23H,1-4H3;3-21H,1-2H3;7-15H,1-6H3;5-13H,1-4H3/b37-34+,38-35+;35-32+,36-33+;26-19+,27-20+;24-16+,25-17+
InChIKeyGCHSYQGCSJIFMU-ZNVFFKJSSA-N
MW1882.21 g/mol
LogP28.30
Rot. Bonds26

About N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine

N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine (PubChem CID 158213071) has the molecular formula C116H104N16O10 and a molecular weight of 1882.21 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine
PubChem CID158213071
Molecular FormulaC116H104N16O10
Molecular Weight1882.21 g/mol
Exact Mass1880.81
IUPAC NameN-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine
SMILESC/C(=N\c1ccc([N+](=O)[O-])cc1C)c1cccc(/C(C)=N/c2ccc([N+](=O)[O-])cc2C)n1.COc1ccc(/N=C(\C)c2cccc(/C(C)=N/c3ccc(C)cc3C)n2)c(C)c1.COc1ccc(/N=C(\c2ccccc2)c2cccc(/C(=N/c3ccc(C)cc3C)c3ccccc3)n2)c(C)c1.Cc1cc([N+](=O)[O-])ccc1/N=C(\c1ccccc1)c1cccc(/C(=N/c2ccc([N+](=O)[O-])cc2C)c2ccccc2)n1
InChIInChI=1S/C35H31N3O.C33H25N5O4.C25H27N3O.C23H21N5O4/c1-24-18-20-30(25(2)22-24)37-34(27-12-7-5-8-13-27)32-16-11-17-33(36-32)35(28-14-9-6-10-15-28)38-31-21-19-29(39-4)23-26(31)3;1-22-20-26(37(39)40)16-18-28(22)35-32(24-10-5-3-6-11-24)30-14-9-15-31(34-30)33(25-12-7-4-8-13-25)36-29-19-17-27(38(41)42)21-23(29)2;1-16-10-12-22(17(2)14-16)26-19(4)24-8-7-9-25(28-24)20(5)27-23-13-11-21(29-6)15-18(23)3;1-14-12-18(27(29)30)8-10-20(14)24-16(3)22-6-5-7-23(26-22)17(4)25-21-11-9-19(28(31)32)13-15(21)2/h5-23H,1-4H3;3-21H,1-2H3;7-15H,1-6H3;5-13H,1-4H3/b37-34+,38-35+;35-32+,36-33+;26-19+,27-20+;24-16+,25-17+
InChIKeyGCHSYQGCSJIFMU-ZNVFFKJSSA-N
XLogP28.30
TPSA341.46 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds26
Heavy Atoms142
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001882.21
LogP ≤ 528.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine?
The IUPAC name of N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine (CID 158213071) is N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine.
What is the SMILES notation for N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine?
The canonical SMILES for N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine is C/C(=N\c1ccc([N+](=O)[O-])cc1C)c1cccc(/C(C)=N/c2ccc([N+](=O)[O-])cc2C)n1.COc1ccc(/N=C(\C)c2cccc(/C(C)=N/c3ccc(C)cc3C)n2)c(C)c1.COc1ccc(/N=C(\c2ccccc2)c2cccc(/C(=N/c3ccc(C)cc3C)c3ccccc3)n2)c(C)c1.Cc1cc([N+](=O)[O-])ccc1/N=C(\c1ccccc1)c1cccc(/C(=N/c2ccc([N+](=O)[O-])cc2C)c2ccccc2)n1.
What is the InChIKey of N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine?
The InChIKey is GCHSYQGCSJIFMU-ZNVFFKJSSA-N. The full InChI is InChI=1S/C35H31N3O.C33H25N5O4.C25H27N3O.C23H21N5O4/c1-24-18-20-30(25(2)22-24)37-34(27-12-7-5-8-13-27)32-16-11-17-33(36-32)35(28-14-9-6-10-15-28)38-31-21-19-29(39-4)23-26(31)3;1-22-20-26(37(39)40)16-18-28(22)35-32(24-10-5-3-6-11-24)30-14-9-15-31(34-30)33(25-12-7-4-8-13-25)36-29-19-17-27(38(41)42)21-23(29)2;1-16-10-12-22(17(2)14-16)26-19(4)24-8-7-9-25(28-24)20(5)27-23-13-11-21(29-6)15-18(23)3;1-14-12-18(27(29)30)8-10-20(14)24-16(3)22-6-5-7-23(26-22)17(4)25-21-11-9-19(28(31)32)13-15(21)2/h5-23H,1-4H3;3-21H,1-2H3;7-15H,1-6H3;5-13H,1-4H3/b37-34+,38-35+;35-32+,36-33+;26-19+,27-20+;24-16+,25-17+.
What are the key properties of N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine?
N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine has a molecular weight of 1882.21 g/mol, XLogP of 28.30, 26 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-methylcarbonimidoyl]-2-pyridinyl]ethanimine;N-(2,4-dimethylphenyl)-1-[6-[N-(4-methoxy-2-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine;1-[6-[C-methyl-N-(2-methyl-4-nitrophenyl)carbonimidoyl]-2-pyridinyl]-N-(2-methyl-4-nitrophenyl)ethanimine;N-(2-methyl-4-nitrophenyl)-1-[6-[N-(2-methyl-4-nitrophenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine is sourced from PubChem (CID 158213071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).