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

C7H7ClF2N2O — CID 130520477

IUPAC5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine
SMILESNc1cncc(Cl)c1OCC(F)F
InChIInChI=1S/C7H7ClF2N2O/c8-4-1-12-2-5(11)7(4)13-3-6(9)10/h1-2,6H,3,11H2
InChIKeyFMLWGKSTNNFNOS-UHFFFAOYSA-N
MW208.60 g/mol
LogP1.96
Rot. Bonds3

About 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine

5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine (PubChem CID 130520477) has the molecular formula C7H7ClF2N2O and a molecular weight of 208.60 g/mol. Its IUPAC name is 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine
PubChem CID130520477
Molecular FormulaC7H7ClF2N2O
Molecular Weight208.60 g/mol
Exact Mass208.02
IUPAC Name5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine
SMILESNc1cncc(Cl)c1OCC(F)F
InChIInChI=1S/C7H7ClF2N2O/c8-4-1-12-2-5(11)7(4)13-3-6(9)10/h1-2,6H,3,11H2
InChIKeyFMLWGKSTNNFNOS-UHFFFAOYSA-N
XLogP1.96
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.60
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine?
The IUPAC name of 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine (CID 130520477) is 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine.
What is the SMILES notation for 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine?
The canonical SMILES for 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine is Nc1cncc(Cl)c1OCC(F)F.
What is the InChIKey of 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine?
The InChIKey is FMLWGKSTNNFNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O/c8-4-1-12-2-5(11)7(4)13-3-6(9)10/h1-2,6H,3,11H2.
What are the key properties of 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine?
5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine has a molecular weight of 208.60 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(2,2-difluoroethoxy)pyridin-3-amine is sourced from PubChem (CID 130520477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).