3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline

C16H18N2 — CID 9060581

IUPAC3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline
SMILESC/C(=N/Nc1cccc(C)c1)c1ccc(C)cc1
InChIInChI=1S/C16H18N2/c1-12-7-9-15(10-8-12)14(3)17-18-16-6-4-5-13(2)11-16/h4-11,18H,1-3H3/b17-14-
InChIKeyJPRYVLBNXAIFNS-VKAVYKQESA-N
MW238.33 g/mol
LogP4.14
Rot. Bonds3

About 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline

3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline (PubChem CID 9060581) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline.

Molecular Properties

Compound Name3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline
PubChem CID9060581
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline
SMILESC/C(=N/Nc1cccc(C)c1)c1ccc(C)cc1
InChIInChI=1S/C16H18N2/c1-12-7-9-15(10-8-12)14(3)17-18-16-6-4-5-13(2)11-16/h4-11,18H,1-3H3/b17-14-
InChIKeyJPRYVLBNXAIFNS-VKAVYKQESA-N
XLogP4.14
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.14
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

ethane;N-[(Z)-1-phenylethylideneamino]aniline
CID 91599108
4-[(E)-N-(3-carboxyanilino)-C-methylcarbonimidoyl]phenolate
CID 135775244
N-[(E)-1-(4-methylphenyl)ethylideneamino]-1-propylpyridin-1-ium-4-amine
CID 73442935
(2Z)-2-amino-2-[(3-methylphenyl)hydrazinylidene]acetic acid
CID 68518581
2-(N-anilino-C-methylcarbonimidoyl)-4-methylphenol
CID 5240881
2-[(Z)-N-anilino-C-methylcarbonimidoyl]-4-methylphenol
CID 136704879
3-methyl-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]benzamide
CID 6271545
N'-[1-(4-fluorophenyl)ethylideneamino]-N-(3-methylphenyl)butanediamide
CID 4033970
N-[[(4-methylphenyl)-phenylmethylidene]amino]aniline
CID 78146288
2-(3-methylphenoxy)-N-[1-(4-methylphenyl)ethylideneamino]acetamide
CID 968545
2-(3-methylanilino)-N-[(Z)-1-(4-propan-2-ylphenyl)ethylideneamino]acetamide
CID 6075641
(E)-3-(3-methylanilino)-1-(4-methylphenyl)but-2-en-1-one
CID 39346765

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline?
The IUPAC name of 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline (CID 9060581) is 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline.
What is the SMILES notation for 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline?
The canonical SMILES for 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline is C/C(=N/Nc1cccc(C)c1)c1ccc(C)cc1.
What is the InChIKey of 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline?
The InChIKey is JPRYVLBNXAIFNS-VKAVYKQESA-N. The full InChI is InChI=1S/C16H18N2/c1-12-7-9-15(10-8-12)14(3)17-18-16-6-4-5-13(2)11-16/h4-11,18H,1-3H3/b17-14-.
What are the key properties of 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline?
3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline has a molecular weight of 238.33 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]aniline is sourced from PubChem (CID 9060581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).