N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline

C22H22N4 — CID 40540962

IUPACN-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline
SMILESCN(/N=C\C(=N/N(C)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22N4/c1-25(20-14-8-4-9-15-20)23-18-22(19-12-6-3-7-13-19)24-26(2)21-16-10-5-11-17-21/h3-18H,1-2H3/b23-18-,24-22+
InChIKeyGXIJACDUNNCGBY-SAYYMRJBSA-N
MW342.45 g/mol
LogP4.65
Rot. Bonds6

About N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline

N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline (PubChem CID 40540962) has the molecular formula C22H22N4 and a molecular weight of 342.45 g/mol. Its IUPAC name is N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline.

Molecular Properties

Compound NameN-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline
PubChem CID40540962
Molecular FormulaC22H22N4
Molecular Weight342.45 g/mol
Exact Mass342.18
IUPAC NameN-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline
SMILESCN(/N=C\C(=N/N(C)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22N4/c1-25(20-14-8-4-9-15-20)23-18-22(19-12-6-3-7-13-19)24-26(2)21-16-10-5-11-17-21/h3-18H,1-2H3/b23-18-,24-22+
InChIKeyGXIJACDUNNCGBY-SAYYMRJBSA-N
XLogP4.65
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-[(3Z)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]-N-methylaniline
CID 6080786
N-methyl-N-[[2-[methyl(phenyl)hydrazinylidene]-1,2-diphenylethylidene]amino]aniline
CID 4287495
methyl (E)-4-[methyl(phenyl)hydrazinylidene]-4-phenylbut-2-enoate
CID 5356889
2-[methyl(phenyl)hydrazinylidene]acetyl chloride
CID 23261017
N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline
CID 18531202
N-methyl-N-[[phenyl(pyridin-2-yl)methylidene]amino]aniline
CID 90750813
2-[methyl(phenyl)hydrazinylidene]propanedioic acid
CID 165345794
methanamine;N-methyl-N-[(E)-[(Z)-2-methylidene-4-(2-methylphenyl)but-3-enylidene]amino]aniline
CID 143565487
2-[[methyl(phenyl)hydrazinylidene]methyl]-N,N-diphenylaniline
CID 71246235
methyl-[(1Z,3E)-3-[(E)-[methyl(phenyl)hydrazinylidene]methyl]hexa-1,3,5-trienyl]azanium
CID 143819841
N-methyl-N-[1-(1-methylpyridin-1-ium-4-yl)ethylideneamino]aniline
CID 71404149
N-methyl-N-[(Z)-1-phenylpentan-2-ylideneamino]aniline
CID 10333162

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline?
The IUPAC name of N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline (CID 40540962) is N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline.
What is the SMILES notation for N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline?
The canonical SMILES for N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline is CN(/N=C\C(=N/N(C)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline?
The InChIKey is GXIJACDUNNCGBY-SAYYMRJBSA-N. The full InChI is InChI=1S/C22H22N4/c1-25(20-14-8-4-9-15-20)23-18-22(19-12-6-3-7-13-19)24-26(2)21-16-10-5-11-17-21/h3-18H,1-2H3/b23-18-,24-22+.
What are the key properties of N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline?
N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline has a molecular weight of 342.45 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline is sourced from PubChem (CID 40540962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).