[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine

C8H10F2N2O — CID 71757854

IUPAC[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine
SMILESNCc1cccc(OCC(F)F)n1
InChIInChI=1S/C8H10F2N2O/c9-7(10)5-13-8-3-1-2-6(4-11)12-8/h1-3,7H,4-5,11H2
InChIKeyHAXNPSBLUUVYAI-UHFFFAOYSA-N
MW188.18 g/mol
LogP1.18
Rot. Bonds4

About [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine

[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine (PubChem CID 71757854) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine
PubChem CID71757854
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine
SMILESNCc1cccc(OCC(F)F)n1
InChIInChI=1S/C8H10F2N2O/c9-7(10)5-13-8-3-1-2-6(4-11)12-8/h1-3,7H,4-5,11H2
InChIKeyHAXNPSBLUUVYAI-UHFFFAOYSA-N
XLogP1.18
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine 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)-2-pyridinyl]methanamine?
The IUPAC name of [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine (CID 71757854) is [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine is NCc1cccc(OCC(F)F)n1.
What is the InChIKey of [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine?
The InChIKey is HAXNPSBLUUVYAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c9-7(10)5-13-8-3-1-2-6(4-11)12-8/h1-3,7H,4-5,11H2.
What are the key properties of [6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine?
[6-(2,2-difluoroethoxy)-2-pyridinyl]methanamine has a molecular weight of 188.18 g/mol, XLogP of 1.18, 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)-2-pyridinyl]methanamine is sourced from PubChem (CID 71757854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).