6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine

C14H14F3N3O — CID 106769427

IUPAC6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCNc1cc(-c2cc(C)ccc2OC)nc(C(F)(F)F)n1
InChIInChI=1S/C14H14F3N3O/c1-8-4-5-11(21-3)9(6-8)10-7-12(18-2)20-13(19-10)14(15,16)17/h4-7H,1-3H3,(H,18,19,20)
InChIKeyUJQPDHZEHPBGPH-UHFFFAOYSA-N
MW297.28 g/mol
LogP3.52
Rot. Bonds3

About 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine

6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 106769427) has the molecular formula C14H14F3N3O and a molecular weight of 297.28 g/mol. Its IUPAC name is 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
PubChem CID106769427
Molecular FormulaC14H14F3N3O
Molecular Weight297.28 g/mol
Exact Mass297.11
IUPAC Name6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCNc1cc(-c2cc(C)ccc2OC)nc(C(F)(F)F)n1
InChIInChI=1S/C14H14F3N3O/c1-8-4-5-11(21-3)9(6-8)10-7-12(18-2)20-13(19-10)14(15,16)17/h4-7H,1-3H3,(H,18,19,20)
InChIKeyUJQPDHZEHPBGPH-UHFFFAOYSA-N
XLogP3.52
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.28
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine 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

6-(2-methoxyphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769157
4-chloro-6-(2-methoxy-5-methylphenyl)-2-(trifluoromethyl)pyrimidine
CID 106768889
6-(5-chloro-2-methoxyphenyl)-4-N-methylpyrimidine-2,4-diamine
CID 90189267
4-(2-methoxy-5-methylphenyl)-2,6-dimethylpyrimidine
CID 116896903
6-(2-fluoro-5-methylphenyl)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716533
4-N-(2-aminoethyl)-6-(2-methoxy-5-methylphenyl)pyrimidine-2,4-diamine
CID 143609875
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-amine
CID 62482749
4-N-(2-bromo-4-methylphenyl)-6-N-methyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770015
2-[4-(2-methoxy-5-methylphenyl)pyrimidin-2-yl]propan-2-amine
CID 116897642
4-methoxy-6-(2-methoxy-5-methylphenyl)pyrimidin-2-amine
CID 114052966
6-(5-chloro-2-methoxyphenyl)-2-ethyl-N-methylpyrimidin-4-amine
CID 80935773
[6-(2-methoxy-5-methylphenyl)pyridazin-3-yl]hydrazine
CID 62044559

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine (CID 106769427) is 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine is CNc1cc(-c2cc(C)ccc2OC)nc(C(F)(F)F)n1.
What is the InChIKey of 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is UJQPDHZEHPBGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N3O/c1-8-4-5-11(21-3)9(6-8)10-7-12(18-2)20-13(19-10)14(15,16)17/h4-7H,1-3H3,(H,18,19,20).
What are the key properties of 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine?
6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 297.28 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxy-5-methylphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 106769427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).