3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine

C7H5Cl2F3N2O — CID 102760405

IUPAC3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
SMILESNc1nc(OCC(F)(F)F)c(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2F3N2O/c8-3-1-4(9)6(14-5(3)13)15-2-7(10,11)12/h1H,2H2,(H2,13,14)
InChIKeyTVMCWBRANPLSSZ-UHFFFAOYSA-N
MW261.03 g/mol
LogP2.91
Rot. Bonds2

About 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine

3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine (PubChem CID 102760405) has the molecular formula C7H5Cl2F3N2O and a molecular weight of 261.03 g/mol. Its IUPAC name is 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
PubChem CID102760405
Molecular FormulaC7H5Cl2F3N2O
Molecular Weight261.03 g/mol
Exact Mass259.97
IUPAC Name3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
SMILESNc1nc(OCC(F)(F)F)c(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2F3N2O/c8-3-1-4(9)6(14-5(3)13)15-2-7(10,11)12/h1H,2H2,(H2,13,14)
InChIKeyTVMCWBRANPLSSZ-UHFFFAOYSA-N
XLogP2.91
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.03
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine (CID 102760405) is 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine is Nc1nc(OCC(F)(F)F)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine?
The InChIKey is TVMCWBRANPLSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2F3N2O/c8-3-1-4(9)6(14-5(3)13)15-2-7(10,11)12/h1H,2H2,(H2,13,14).
What are the key properties of 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine?
3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine has a molecular weight of 261.03 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(2,2,2-trifluoroethoxy)pyridin-2-amine is sourced from PubChem (CID 102760405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).