N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline

C20H18N2 — CID 78146288

IUPACN-[[(4-methylphenyl)-phenylmethylidene]amino]aniline
SMILESCc1ccc(C(=NNc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-16-12-14-18(15-13-16)20(17-8-4-2-5-9-17)22-21-19-10-6-3-7-11-19/h2-15,21H,1H3
InChIKeyPWJLTCQVDYGOIK-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.86
Rot. Bonds4

About N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline

N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline (PubChem CID 78146288) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline.

Molecular Properties

Compound NameN-[[(4-methylphenyl)-phenylmethylidene]amino]aniline
PubChem CID78146288
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC NameN-[[(4-methylphenyl)-phenylmethylidene]amino]aniline
SMILESCc1ccc(C(=NNc2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N2/c1-16-12-14-18(15-13-16)20(17-8-4-2-5-9-17)22-21-19-10-6-3-7-11-19/h2-15,21H,1H3
InChIKeyPWJLTCQVDYGOIK-UHFFFAOYSA-N
XLogP4.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[bis(4-methylphenyl)methylideneamino]-4-methylaniline
CID 59951194
2-[(Z)-N-anilino-C-phenylcarbonimidoyl]-4-methylphenol
CID 136704880
(E)-N-(4-methylphenyl)benzenecarbohydrazonoyl chloride
CID 11207300
(NZ)-N-[(4-methylphenyl)-phenylmethylidene]hydroxylamine
CID 6303063
4-[(Z)-N-anilino-C-(4-fluorophenyl)carbonimidoyl]phenol
CID 135903575
N-[(E)-[(4-methylphenyl)-nitromethylidene]amino]aniline
CID 6277211
4-methyl-N-[(E)-[phenyl-(5-phenyl-1,2-oxazol-3-yl)methylidene]amino]aniline
CID 177388394
4-[(E)-N-anilino-C-phenylcarbonimidoyl]-2,6-ditert-butylphenol
CID 135598899
N-(benzhydrylideneamino)-2-(4-methylphenyl)-2-oxoacetamide
CID 134030110
N-[(E)-1,2-diphenylethylideneamino]-4-methylaniline
CID 135051683
ethane;N-[(Z)-1-phenylethylideneamino]aniline
CID 91599108
ethyl (2E)-2-(4-methylphenyl)-2-(phenylhydrazinylidene)acetate
CID 159563587

Frequently Asked Questions

What is the IUPAC name of N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline?
The IUPAC name of N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline (CID 78146288) is N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline.
What is the SMILES notation for N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline?
The canonical SMILES for N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline is Cc1ccc(C(=NNc2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline?
The InChIKey is PWJLTCQVDYGOIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2/c1-16-12-14-18(15-13-16)20(17-8-4-2-5-9-17)22-21-19-10-6-3-7-11-19/h2-15,21H,1H3.
What are the key properties of N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline?
N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline has a molecular weight of 286.38 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline is sourced from PubChem (CID 78146288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).