2,5-difluoro-3H-imidazo[1,5-a]pyridine

C7H6F2N2 — CID 139478688

IUPAC2,5-difluoro-3H-imidazo[1,5-a]pyridine
SMILESFC1=CC=CC2=CN(F)CN12
InChIInChI=1S/C7H6F2N2/c8-7-3-1-2-6-4-10(9)5-11(6)7/h1-4H,5H2
InChIKeyGVUJARRFPKOVEV-UHFFFAOYSA-N
MW156.14 g/mol
LogP1.67
Rot. Bonds

About 2,5-difluoro-3H-imidazo[1,5-a]pyridine

2,5-difluoro-3H-imidazo[1,5-a]pyridine (PubChem CID 139478688) has the molecular formula C7H6F2N2 and a molecular weight of 156.14 g/mol. Its IUPAC name is 2,5-difluoro-3H-imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name2,5-difluoro-3H-imidazo[1,5-a]pyridine
PubChem CID139478688
Molecular FormulaC7H6F2N2
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name2,5-difluoro-3H-imidazo[1,5-a]pyridine
SMILESFC1=CC=CC2=CN(F)CN12
InChIInChI=1S/C7H6F2N2/c8-7-3-1-2-6-4-10(9)5-11(6)7/h1-4H,5H2
InChIKeyGVUJARRFPKOVEV-UHFFFAOYSA-N
XLogP1.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-3H-imidazo[1,5-a]pyridine?
The IUPAC name of 2,5-difluoro-3H-imidazo[1,5-a]pyridine (CID 139478688) is 2,5-difluoro-3H-imidazo[1,5-a]pyridine.
What is the SMILES notation for 2,5-difluoro-3H-imidazo[1,5-a]pyridine?
The canonical SMILES for 2,5-difluoro-3H-imidazo[1,5-a]pyridine is FC1=CC=CC2=CN(F)CN12.
What is the InChIKey of 2,5-difluoro-3H-imidazo[1,5-a]pyridine?
The InChIKey is GVUJARRFPKOVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2/c8-7-3-1-2-6-4-10(9)5-11(6)7/h1-4H,5H2.
What are the key properties of 2,5-difluoro-3H-imidazo[1,5-a]pyridine?
2,5-difluoro-3H-imidazo[1,5-a]pyridine has a molecular weight of 156.14 g/mol, XLogP of 1.67, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-3H-imidazo[1,5-a]pyridine is sourced from PubChem (CID 139478688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).