6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine

C9H12F2N2O — CID 151133341

IUPAC6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine
SMILESCNc1ccc(OCC(F)F)nc1C
InChIInChI=1S/C9H12F2N2O/c1-6-7(12-2)3-4-9(13-6)14-5-8(10)11/h3-4,8,12H,5H2,1-2H3
InChIKeyMURQMKOMJWKWRE-UHFFFAOYSA-N
MW202.20 g/mol
LogP2.08
Rot. Bonds4

About 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine

6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine (PubChem CID 151133341) has the molecular formula C9H12F2N2O and a molecular weight of 202.20 g/mol. Its IUPAC name is 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine.

Molecular Properties

Compound Name6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine
PubChem CID151133341
Molecular FormulaC9H12F2N2O
Molecular Weight202.20 g/mol
Exact Mass202.09
IUPAC Name6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine
SMILESCNc1ccc(OCC(F)F)nc1C
InChIInChI=1S/C9H12F2N2O/c1-6-7(12-2)3-4-9(13-6)14-5-8(10)11/h3-4,8,12H,5H2,1-2H3
InChIKeyMURQMKOMJWKWRE-UHFFFAOYSA-N
XLogP2.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-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 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine?
The IUPAC name of 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine (CID 151133341) is 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine.
What is the SMILES notation for 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine?
The canonical SMILES for 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine is CNc1ccc(OCC(F)F)nc1C.
What is the InChIKey of 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine?
The InChIKey is MURQMKOMJWKWRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2O/c1-6-7(12-2)3-4-9(13-6)14-5-8(10)11/h3-4,8,12H,5H2,1-2H3.
What are the key properties of 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine?
6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine has a molecular weight of 202.20 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-difluoroethoxy)-N,2-dimethylpyridin-3-amine is sourced from PubChem (CID 151133341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).