4-(2,2-difluoroethoxy)pyridin-3-amine

C7H8F2N2O — CID 78992164

IUPAC4-(2,2-difluoroethoxy)pyridin-3-amine
SMILESNc1cnccc1OCC(F)F
InChIInChI=1S/C7H8F2N2O/c8-7(9)4-12-6-1-2-11-3-5(6)10/h1-3,7H,4,10H2
InChIKeyQFIMWDLQXPQFMR-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.31
Rot. Bonds3

About 4-(2,2-difluoroethoxy)pyridin-3-amine

4-(2,2-difluoroethoxy)pyridin-3-amine (PubChem CID 78992164) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is 4-(2,2-difluoroethoxy)pyridin-3-amine.

Molecular Properties

Compound Name4-(2,2-difluoroethoxy)pyridin-3-amine
PubChem CID78992164
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name4-(2,2-difluoroethoxy)pyridin-3-amine
SMILESNc1cnccc1OCC(F)F
InChIInChI=1S/C7H8F2N2O/c8-7(9)4-12-6-1-2-11-3-5(6)10/h1-3,7H,4,10H2
InChIKeyQFIMWDLQXPQFMR-UHFFFAOYSA-N
XLogP1.31
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoroethoxy)pyridin-3-amine?
The IUPAC name of 4-(2,2-difluoroethoxy)pyridin-3-amine (CID 78992164) is 4-(2,2-difluoroethoxy)pyridin-3-amine.
What is the SMILES notation for 4-(2,2-difluoroethoxy)pyridin-3-amine?
The canonical SMILES for 4-(2,2-difluoroethoxy)pyridin-3-amine is Nc1cnccc1OCC(F)F.
What is the InChIKey of 4-(2,2-difluoroethoxy)pyridin-3-amine?
The InChIKey is QFIMWDLQXPQFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c8-7(9)4-12-6-1-2-11-3-5(6)10/h1-3,7H,4,10H2.
What are the key properties of 4-(2,2-difluoroethoxy)pyridin-3-amine?
4-(2,2-difluoroethoxy)pyridin-3-amine has a molecular weight of 174.15 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoroethoxy)pyridin-3-amine is sourced from PubChem (CID 78992164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).