4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline

C11H11ClN4O2 — CID 62859687

IUPAC4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline
SMILESCNc1ccc(Oc2nc(Cl)nc(OC)n2)cc1
InChIInChI=1S/C11H11ClN4O2/c1-13-7-3-5-8(6-4-7)18-11-15-9(12)14-10(16-11)17-2/h3-6,13H,1-2H3
InChIKeyYPXQVRCTMXPQKA-UHFFFAOYSA-N
MW266.69 g/mol
LogP2.37
Rot. Bonds4

About 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline

4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline (PubChem CID 62859687) has the molecular formula C11H11ClN4O2 and a molecular weight of 266.69 g/mol. Its IUPAC name is 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline.

Molecular Properties

Compound Name4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline
PubChem CID62859687
Molecular FormulaC11H11ClN4O2
Molecular Weight266.69 g/mol
Exact Mass266.06
IUPAC Name4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline
SMILESCNc1ccc(Oc2nc(Cl)nc(OC)n2)cc1
InChIInChI=1S/C11H11ClN4O2/c1-13-7-3-5-8(6-4-7)18-11-15-9(12)14-10(16-11)17-2/h3-6,13H,1-2H3
InChIKeyYPXQVRCTMXPQKA-UHFFFAOYSA-N
XLogP2.37
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.69
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline 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-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline?
The IUPAC name of 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline (CID 62859687) is 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline.
What is the SMILES notation for 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline?
The canonical SMILES for 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline is CNc1ccc(Oc2nc(Cl)nc(OC)n2)cc1.
What is the InChIKey of 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline?
The InChIKey is YPXQVRCTMXPQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4O2/c1-13-7-3-5-8(6-4-7)18-11-15-9(12)14-10(16-11)17-2/h3-6,13H,1-2H3.
What are the key properties of 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline?
4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline has a molecular weight of 266.69 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline is sourced from PubChem (CID 62859687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).