N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline

C14H16N4 — CID 5357669

IUPACN-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline
SMILESCN(/N=N/N(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16N4/c1-17(13-9-5-3-6-10-13)15-16-18(2)14-11-7-4-8-12-14/h3-12H,1-2H3/b16-15+
InChIKeyWRINSSLBPNLASA-FOCLMDBBSA-N
MW240.31 g/mol
LogP3.54
Rot. Bonds4

About N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline

N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline (PubChem CID 5357669) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline.

Molecular Properties

Compound NameN-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline
PubChem CID5357669
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC NameN-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline
SMILESCN(/N=N/N(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H16N4/c1-17(13-9-5-3-6-10-13)15-16-18(2)14-11-7-4-8-12-14/h3-12H,1-2H3/b16-15+
InChIKeyWRINSSLBPNLASA-FOCLMDBBSA-N
XLogP3.54
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline?
The IUPAC name of N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline (CID 5357669) is N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline.
What is the SMILES notation for N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline?
The canonical SMILES for N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline is CN(/N=N/N(C)c1ccccc1)c1ccccc1.
What is the InChIKey of N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline?
The InChIKey is WRINSSLBPNLASA-FOCLMDBBSA-N. The full InChI is InChI=1S/C14H16N4/c1-17(13-9-5-3-6-10-13)15-16-18(2)14-11-7-4-8-12-14/h3-12H,1-2H3/b16-15+.
What are the key properties of N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline?
N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline has a molecular weight of 240.31 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(E)-(N-methylanilino)diazenyl]aniline is sourced from PubChem (CID 5357669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).