6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

C11H15F3N2O2 — CID 102719982

IUPAC6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(OC(C)COC)n1
InChIInChI=1S/C11H15F3N2O2/c1-7(6-17-3)18-10-5-8(11(12,13)14)4-9(15-2)16-10/h4-5,7H,6H2,1-3H3,(H,15,16)
InChIKeyFBZVPYRHTAXGCD-UHFFFAOYSA-N
MW264.25 g/mol
LogP2.56
Rot. Bonds5

About 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine

6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102719982) has the molecular formula C11H15F3N2O2 and a molecular weight of 264.25 g/mol. Its IUPAC name is 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102719982
Molecular FormulaC11H15F3N2O2
Molecular Weight264.25 g/mol
Exact Mass264.11
IUPAC Name6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(OC(C)COC)n1
InChIInChI=1S/C11H15F3N2O2/c1-7(6-17-3)18-10-5-8(11(12,13)14)4-9(15-2)16-10/h4-5,7H,6H2,1-3H3,(H,15,16)
InChIKeyFBZVPYRHTAXGCD-UHFFFAOYSA-N
XLogP2.56
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine (CID 102719982) is 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(OC(C)COC)n1.
What is the InChIKey of 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is FBZVPYRHTAXGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O2/c1-7(6-17-3)18-10-5-8(11(12,13)14)4-9(15-2)16-10/h4-5,7H,6H2,1-3H3,(H,15,16).
What are the key properties of 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine?
6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 264.25 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methoxypropan-2-yloxy)-N-methyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102719982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).