4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline

C15H18N4 — CID 101351055

IUPAC4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline
SMILESCc1nc(C)nc(/C=C/c2ccc(N(C)C)cc2)n1
InChIInChI=1S/C15H18N4/c1-11-16-12(2)18-15(17-11)10-7-13-5-8-14(9-6-13)19(3)4/h5-10H,1-4H3/b10-7+
InChIKeyDTCQYLRYLNTMGV-JXMROGBWSA-N
MW254.34 g/mol
LogP2.72
Rot. Bonds3

About 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline

4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline (PubChem CID 101351055) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline
PubChem CID101351055
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline
SMILESCc1nc(C)nc(/C=C/c2ccc(N(C)C)cc2)n1
InChIInChI=1S/C15H18N4/c1-11-16-12(2)18-15(17-11)10-7-13-5-8-14(9-6-13)19(3)4/h5-10H,1-4H3/b10-7+
InChIKeyDTCQYLRYLNTMGV-JXMROGBWSA-N
XLogP2.72
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}

Analyze 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline 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 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline (CID 101351055) is 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline is Cc1nc(C)nc(/C=C/c2ccc(N(C)C)cc2)n1.
What is the InChIKey of 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline?
The InChIKey is DTCQYLRYLNTMGV-JXMROGBWSA-N. The full InChI is InChI=1S/C15H18N4/c1-11-16-12(2)18-15(17-11)10-7-13-5-8-14(9-6-13)19(3)4/h5-10H,1-4H3/b10-7+.
What are the key properties of 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline?
4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline has a molecular weight of 254.34 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4,6-dimethyl-1,3,5-triazin-2-yl)ethenyl]-N,N-dimethylaniline is sourced from PubChem (CID 101351055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).