3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

C14H8F2N2O — CID 82483282

IUPAC3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2ccc(F)c(F)c2)n2ccccc12
InChIInChI=1S/C14H8F2N2O/c15-10-5-4-9(7-11(10)16)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H
InChIKeySBOPFKXIUWTNKS-UHFFFAOYSA-N
MW258.23 g/mol
LogP3.09
Rot. Bonds2

About 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 82483282) has the molecular formula C14H8F2N2O and a molecular weight of 258.23 g/mol. Its IUPAC name is 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID82483282
Molecular FormulaC14H8F2N2O
Molecular Weight258.23 g/mol
Exact Mass258.06
IUPAC Name3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2ccc(F)c(F)c2)n2ccccc12
InChIInChI=1S/C14H8F2N2O/c15-10-5-4-9(7-11(10)16)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H
InChIKeySBOPFKXIUWTNKS-UHFFFAOYSA-N
XLogP3.09
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.23
LogP ≤ 53.09
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-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 116836651
3-(3,5-dimethoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 28752017
3-thiophen-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 957617
CID 89207227
CID 89207227
6-chloro-3-phenylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84742339
N-[[3-(4-chlorophenyl)imidazo[1,5-a]pyridin-1-yl]methylidene]hydroxylamine
CID 693245
3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine
CID 116836498
3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84760068
3-[2-(4-fluorophenyl)ethyl]imidazo[1,5-a]pyridine-1-carbaldehyde
CID 28752029
7-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745096
1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84742895
3-(3-bromophenyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745250

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (CID 82483282) is 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is O=Cc1nc(-c2ccc(F)c(F)c2)n2ccccc12.
What is the InChIKey of 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is SBOPFKXIUWTNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N2O/c15-10-5-4-9(7-11(10)16)14-17-12(8-19)13-3-1-2-6-18(13)14/h1-8H.
What are the key properties of 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 258.23 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 82483282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).