5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine

C7H7BrF2N2 — CID 135394835

IUPAC5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine
SMILESNc1ccc(Br)c(CC(F)F)n1
InChIInChI=1S/C7H7BrF2N2/c8-4-1-2-7(11)12-5(4)3-6(9)10/h1-2,6H,3H2,(H2,11,12)
InChIKeyLZCFIANNYFBEGU-UHFFFAOYSA-N
MW237.05 g/mol
LogP2.23
Rot. Bonds2

About 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine

5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine (PubChem CID 135394835) has the molecular formula C7H7BrF2N2 and a molecular weight of 237.05 g/mol. Its IUPAC name is 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine
PubChem CID135394835
Molecular FormulaC7H7BrF2N2
Molecular Weight237.05 g/mol
Exact Mass235.98
IUPAC Name5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine
SMILESNc1ccc(Br)c(CC(F)F)n1
InChIInChI=1S/C7H7BrF2N2/c8-4-1-2-7(11)12-5(4)3-6(9)10/h1-2,6H,3H2,(H2,11,12)
InChIKeyLZCFIANNYFBEGU-UHFFFAOYSA-N
XLogP2.23
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.05
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine?
The IUPAC name of 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine (CID 135394835) is 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine is Nc1ccc(Br)c(CC(F)F)n1.
What is the InChIKey of 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine?
The InChIKey is LZCFIANNYFBEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrF2N2/c8-4-1-2-7(11)12-5(4)3-6(9)10/h1-2,6H,3H2,(H2,11,12).
What are the key properties of 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine?
5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine has a molecular weight of 237.05 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(2,2-difluoroethyl)pyridin-2-amine is sourced from PubChem (CID 135394835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).