N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine

C14H13F3N2O — CID 102719830

IUPACN-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(Oc2ccccc2C)n1
InChIInChI=1S/C14H13F3N2O/c1-9-5-3-4-6-11(9)20-13-8-10(14(15,16)17)7-12(18-2)19-13/h3-8H,1-2H3,(H,18,19)
InChIKeyYAWFPXAQNNLVDB-UHFFFAOYSA-N
MW282.27 g/mol
LogP4.24
Rot. Bonds3

About N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine

N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102719830) has the molecular formula C14H13F3N2O and a molecular weight of 282.27 g/mol. Its IUPAC name is N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102719830
Molecular FormulaC14H13F3N2O
Molecular Weight282.27 g/mol
Exact Mass282.10
IUPAC NameN-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(Oc2ccccc2C)n1
InChIInChI=1S/C14H13F3N2O/c1-9-5-3-4-6-11(9)20-13-8-10(14(15,16)17)7-12(18-2)19-13/h3-8H,1-2H3,(H,18,19)
InChIKeyYAWFPXAQNNLVDB-UHFFFAOYSA-N
XLogP4.24
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine (CID 102719830) is N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(Oc2ccccc2C)n1.
What is the InChIKey of N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is YAWFPXAQNNLVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c1-9-5-3-4-6-11(9)20-13-8-10(14(15,16)17)7-12(18-2)19-13/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine?
N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 282.27 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-methylphenoxy)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102719830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).