2-(2-azido-1,1-difluoroethyl)pyridine

C7H6F2N4 — CID 11805405

IUPAC2-(2-azido-1,1-difluoroethyl)pyridine
SMILES[N-]=[N+]=NCC(F)(F)c1ccccn1
InChIInChI=1S/C7H6F2N4/c8-7(9,5-12-13-10)6-3-1-2-4-11-6/h1-4H,5H2
InChIKeyUEQIOIGGEPWPMI-UHFFFAOYSA-N
MW184.15 g/mol
LogP2.48
Rot. Bonds3

About 2-(2-azido-1,1-difluoroethyl)pyridine

2-(2-azido-1,1-difluoroethyl)pyridine (PubChem CID 11805405) has the molecular formula C7H6F2N4 and a molecular weight of 184.15 g/mol. Its IUPAC name is 2-(2-azido-1,1-difluoroethyl)pyridine.

Molecular Properties

Compound Name2-(2-azido-1,1-difluoroethyl)pyridine
PubChem CID11805405
Molecular FormulaC7H6F2N4
Molecular Weight184.15 g/mol
Exact Mass184.06
IUPAC Name2-(2-azido-1,1-difluoroethyl)pyridine
SMILES[N-]=[N+]=NCC(F)(F)c1ccccn1
InChIInChI=1S/C7H6F2N4/c8-7(9,5-12-13-10)6-3-1-2-4-11-6/h1-4H,5H2
InChIKeyUEQIOIGGEPWPMI-UHFFFAOYSA-N
XLogP2.48
TPSA61.65 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.15
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 2-(2-azido-1,1-difluoroethyl)pyridine 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 2-(2-azido-1,1-difluoroethyl)pyridine?
The IUPAC name of 2-(2-azido-1,1-difluoroethyl)pyridine (CID 11805405) is 2-(2-azido-1,1-difluoroethyl)pyridine.
What is the SMILES notation for 2-(2-azido-1,1-difluoroethyl)pyridine?
The canonical SMILES for 2-(2-azido-1,1-difluoroethyl)pyridine is [N-]=[N+]=NCC(F)(F)c1ccccn1.
What is the InChIKey of 2-(2-azido-1,1-difluoroethyl)pyridine?
The InChIKey is UEQIOIGGEPWPMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N4/c8-7(9,5-12-13-10)6-3-1-2-4-11-6/h1-4H,5H2.
What are the key properties of 2-(2-azido-1,1-difluoroethyl)pyridine?
2-(2-azido-1,1-difluoroethyl)pyridine has a molecular weight of 184.15 g/mol, XLogP of 2.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-azido-1,1-difluoroethyl)pyridine is sourced from PubChem (CID 11805405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).