2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine

C8H5Cl2FN2 — CID 170973422

IUPAC2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine
SMILESFc1ccn2cc(C(Cl)Cl)nc2c1
InChIInChI=1S/C8H5Cl2FN2/c9-8(10)6-4-13-2-1-5(11)3-7(13)12-6/h1-4,8H
InChIKeyGBJHJXMALUBEGC-UHFFFAOYSA-N
MW219.05 g/mol
LogP2.95
Rot. Bonds1

About 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine

2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine (PubChem CID 170973422) has the molecular formula C8H5Cl2FN2 and a molecular weight of 219.05 g/mol. Its IUPAC name is 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine
PubChem CID170973422
Molecular FormulaC8H5Cl2FN2
Molecular Weight219.05 g/mol
Exact Mass217.98
IUPAC Name2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine
SMILESFc1ccn2cc(C(Cl)Cl)nc2c1
InChIInChI=1S/C8H5Cl2FN2/c9-8(10)6-4-13-2-1-5(11)3-7(13)12-6/h1-4,8H
InChIKeyGBJHJXMALUBEGC-UHFFFAOYSA-N
XLogP2.95
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.05
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine?
The IUPAC name of 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine (CID 170973422) is 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine is Fc1ccn2cc(C(Cl)Cl)nc2c1.
What is the InChIKey of 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine?
The InChIKey is GBJHJXMALUBEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5Cl2FN2/c9-8(10)6-4-13-2-1-5(11)3-7(13)12-6/h1-4,8H.
What are the key properties of 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine?
2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine has a molecular weight of 219.05 g/mol, XLogP of 2.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dichloromethyl)-7-fluoroimidazo[1,2-a]pyridine is sourced from PubChem (CID 170973422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).