3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

C14H8BrFN2O — CID 116836651

IUPAC3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2cc(Br)ccc2F)n2ccccc12
InChIInChI=1S/C14H8BrFN2O/c15-9-4-5-11(16)10(7-9)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H
InChIKeyMGOWMAMKSAFPQV-UHFFFAOYSA-N
MW319.13 g/mol
LogP3.72
Rot. Bonds2

About 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 116836651) has the molecular formula C14H8BrFN2O and a molecular weight of 319.13 g/mol. Its IUPAC name is 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID116836651
Molecular FormulaC14H8BrFN2O
Molecular Weight319.13 g/mol
Exact Mass317.98
IUPAC Name3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2cc(Br)ccc2F)n2ccccc12
InChIInChI=1S/C14H8BrFN2O/c15-9-4-5-11(16)10(7-9)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H
InChIKeyMGOWMAMKSAFPQV-UHFFFAOYSA-N
XLogP3.72
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.13
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 82483282
3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 116836636
3-thiophen-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 957617
3-(3,5-dimethoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 28752017
CID 89207227
CID 89207227
7-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745096
1-bromo-3-(2,4-difluorophenyl)imidazo[1,5-a]pyridine
CID 116836595
2-(5-bromo-2-fluorophenyl)pteridine-4-carbaldehyde
CID 174559883
3-(3-bromophenyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745250
7-bromo-3-(furan-2-yl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743759
4-bromo-2-(3-phenylimidazo[1,5-a]pyridin-1-yl)phenol
CID 155115095
1-(4-chlorophenyl)-3-(2-fluorophenyl)imidazo[1,5-a]pyridine
CID 132581655

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (CID 116836651) is 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is O=Cc1nc(-c2cc(Br)ccc2F)n2ccccc12.
What is the InChIKey of 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is MGOWMAMKSAFPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrFN2O/c15-9-4-5-11(16)10(7-9)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H.
What are the key properties of 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 319.13 g/mol, XLogP of 3.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 116836651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).