3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine

C12H9Cl2FN2O — CID 102760972

IUPAC3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine
SMILESNc1nc(OCc2ccccc2F)c(Cl)cc1Cl
InChIInChI=1S/C12H9Cl2FN2O/c13-8-5-9(14)12(17-11(8)16)18-6-7-3-1-2-4-10(7)15/h1-5H,6H2,(H2,16,17)
InChIKeyBHFCLQITXDVJPJ-UHFFFAOYSA-N
MW287.12 g/mol
LogP3.69
Rot. Bonds3

About 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine

3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine (PubChem CID 102760972) has the molecular formula C12H9Cl2FN2O and a molecular weight of 287.12 g/mol. Its IUPAC name is 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine
PubChem CID102760972
Molecular FormulaC12H9Cl2FN2O
Molecular Weight287.12 g/mol
Exact Mass286.01
IUPAC Name3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine
SMILESNc1nc(OCc2ccccc2F)c(Cl)cc1Cl
InChIInChI=1S/C12H9Cl2FN2O/c13-8-5-9(14)12(17-11(8)16)18-6-7-3-1-2-4-10(7)15/h1-5H,6H2,(H2,16,17)
InChIKeyBHFCLQITXDVJPJ-UHFFFAOYSA-N
XLogP3.69
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.12
LogP ≤ 53.69
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-fluorophenyl)methoxy]pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine (CID 102760972) is 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine is Nc1nc(OCc2ccccc2F)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine?
The InChIKey is BHFCLQITXDVJPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2FN2O/c13-8-5-9(14)12(17-11(8)16)18-6-7-3-1-2-4-10(7)15/h1-5H,6H2,(H2,16,17).
What are the key properties of 3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine?
3,5-dichloro-6-[(2-fluorophenyl)methoxy]pyridin-2-amine has a molecular weight of 287.12 g/mol, XLogP of 3.69, 3 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-fluorophenyl)methoxy]pyridin-2-amine is sourced from PubChem (CID 102760972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).