2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine

C12H7ClFN3 — CID 104573626

IUPAC2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine
SMILESFc1ccc(-c2cn3ccncc3n2)cc1Cl
InChIInChI=1S/C12H7ClFN3/c13-9-5-8(1-2-10(9)14)11-7-17-4-3-15-6-12(17)16-11/h1-7H
InChIKeyAOGYNRCLSYGKFV-UHFFFAOYSA-N
MW247.66 g/mol
LogP3.19
Rot. Bonds1

About 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine

2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine (PubChem CID 104573626) has the molecular formula C12H7ClFN3 and a molecular weight of 247.66 g/mol. Its IUPAC name is 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine
PubChem CID104573626
Molecular FormulaC12H7ClFN3
Molecular Weight247.66 g/mol
Exact Mass247.03
IUPAC Name2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine
SMILESFc1ccc(-c2cn3ccncc3n2)cc1Cl
InChIInChI=1S/C12H7ClFN3/c13-9-5-8(1-2-10(9)14)11-7-17-4-3-15-6-12(17)16-11/h1-7H
InChIKeyAOGYNRCLSYGKFV-UHFFFAOYSA-N
XLogP3.19
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.66
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine (CID 104573626) is 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine is Fc1ccc(-c2cn3ccncc3n2)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine?
The InChIKey is AOGYNRCLSYGKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClFN3/c13-9-5-8(1-2-10(9)14)11-7-17-4-3-15-6-12(17)16-11/h1-7H.
What are the key properties of 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine?
2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine has a molecular weight of 247.66 g/mol, XLogP of 3.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-fluorophenyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 104573626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).