N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline

C23H24N6 — CID 18531202

IUPACN-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline
SMILESCN(/N=C/C(/C=N/Nc1ccccc1)=N/N(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N6/c1-28(22-14-8-4-9-15-22)25-19-21(18-24-26-20-12-6-3-7-13-20)27-29(2)23-16-10-5-11-17-23/h3-19,26H,1-2H3/b24-18+,25-19+,27-21+
InChIKeyYKJBLFNLWXENGX-HGJJJYCWSA-N
MW384.49 g/mol
LogP4.70
Rot. Bonds8

About N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline

N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline (PubChem CID 18531202) has the molecular formula C23H24N6 and a molecular weight of 384.49 g/mol. Its IUPAC name is N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline.

Molecular Properties

Compound NameN-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline
PubChem CID18531202
Molecular FormulaC23H24N6
Molecular Weight384.49 g/mol
Exact Mass384.21
IUPAC NameN-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline
SMILESCN(/N=C/C(/C=N/Nc1ccccc1)=N/N(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N6/c1-28(22-14-8-4-9-15-22)25-19-21(18-24-26-20-12-6-3-7-13-20)27-29(2)23-16-10-5-11-17-23/h3-19,26H,1-2H3/b24-18+,25-19+,27-21+
InChIKeyYKJBLFNLWXENGX-HGJJJYCWSA-N
XLogP4.70
TPSA55.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.49
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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-[(Z)-[(2Z)-2-[methyl(phenyl)hydrazinylidene]-2-phenylethylidene]amino]aniline
CID 40540962
2-[methyl(phenyl)hydrazinylidene]acetyl chloride
CID 23261017
2,3-bis(phenylhydrazinylidene)propanal
CID 6399152
2-(phenylhydrazinylidene)-1-[4-[2-(phenylhydrazinylidene)acetyl]phenyl]ethanone
CID 2749285
2-[methyl(phenyl)hydrazinylidene]propanedioic acid
CID 165345794
(Z,4Z)-2,3-dibromo-4-[methyl-(3-methylphenyl)hydrazinylidene]but-2-enal
CID 126535167
N-methyl-N-[[2-[methyl(phenyl)hydrazinylidene]-1,2-diphenylethylidene]amino]aniline
CID 4287495
ethane;ethyl (2E)-2-(phenylhydrazinylidene)acetate
CID 90967313
(1E,2E)-N-phenyl-2-(phenylhydrazinylidene)ethanehydrazonoyl chloride
CID 134879796
(2E)-N'-anilino-2-(phenylhydrazinylidene)ethanimidamide
CID 15309595
N-[3-hydroxyimino-2-(phenylhydrazinylidene)propylidene]hydroxylamine
CID 137198938

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline?
The IUPAC name of N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline (CID 18531202) is N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline.
What is the SMILES notation for N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline?
The canonical SMILES for N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline is CN(/N=C/C(/C=N/Nc1ccccc1)=N/N(C)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline?
The InChIKey is YKJBLFNLWXENGX-HGJJJYCWSA-N. The full InChI is InChI=1S/C23H24N6/c1-28(22-14-8-4-9-15-22)25-19-21(18-24-26-20-12-6-3-7-13-20)27-29(2)23-16-10-5-11-17-23/h3-19,26H,1-2H3/b24-18+,25-19+,27-21+.
What are the key properties of N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline?
N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline has a molecular weight of 384.49 g/mol, XLogP of 4.70, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[(2E,3E)-2,3-bis[methyl(phenyl)hydrazinylidene]propylidene]amino]aniline is sourced from PubChem (CID 18531202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).