2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine

C11H7ClF3N3O2 — CID 62857484

IUPAC2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C11H7ClF3N3O2/c1-19-9-16-8(12)17-10(18-9)20-7-4-2-6(3-5-7)11(13,14)15/h2-5H,1H3
InChIKeyIBIPNSJCUMAIRK-UHFFFAOYSA-N
MW305.64 g/mol
LogP3.34
Rot. Bonds3

About 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine

2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine (PubChem CID 62857484) has the molecular formula C11H7ClF3N3O2 and a molecular weight of 305.64 g/mol. Its IUPAC name is 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine
PubChem CID62857484
Molecular FormulaC11H7ClF3N3O2
Molecular Weight305.64 g/mol
Exact Mass305.02
IUPAC Name2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C11H7ClF3N3O2/c1-19-9-16-8(12)17-10(18-9)20-7-4-2-6(3-5-7)11(13,14)15/h2-5H,1H3
InChIKeyIBIPNSJCUMAIRK-UHFFFAOYSA-N
XLogP3.34
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.64
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine with MolForge

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

Launch Full Analysis

Related Compounds

4-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)oxy]-N-methylaniline
CID 62859687
2,4-dichloro-6-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)oxy]phenoxy]-1,3,5-triazine
CID 10341266
2-chloro-4-methyl-6-[4-(trifluoromethyl)phenoxy]pyrimidine
CID 62476947
5-bromo-4-methoxy-2-[4-(trifluoromethyl)phenoxy]pyrimidine
CID 106999154
2-chloro-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methoxy-1,3,5-triazine
CID 102722071
2-chloro-4-methoxy-6-(3-methyl-4-nitrophenoxy)-1,3,5-triazine
CID 62858305
2,4-dichloro-6-phenoxy-1,3,5-triazine;ethane
CID 91071262
2-(4-bromophenoxy)-4,6-dichloro-1,3,5-triazine
CID 3858351
1-methoxy-2-[4-(trifluoromethyl)phenoxy]benzene
CID 76546119
2-ethyl-4-methoxy-6-(4-methoxyphenoxy)-1,3,5-triazine
CID 164725212
5-chloro-1-methyl-2-[4-(trifluoromethyl)phenoxy]imidazole
CID 117260362
4-chloro-N-ethyl-6-(4-methoxyphenoxy)-1,3,5-triazin-2-amine
CID 80870348

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine?
The IUPAC name of 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine (CID 62857484) is 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine is COc1nc(Cl)nc(Oc2ccc(C(F)(F)F)cc2)n1.
What is the InChIKey of 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine?
The InChIKey is IBIPNSJCUMAIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF3N3O2/c1-19-9-16-8(12)17-10(18-9)20-7-4-2-6(3-5-7)11(13,14)15/h2-5H,1H3.
What are the key properties of 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine?
2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine has a molecular weight of 305.64 g/mol, XLogP of 3.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methoxy-6-[4-(trifluoromethyl)phenoxy]-1,3,5-triazine is sourced from PubChem (CID 62857484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).