6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

C14H8BrClN2O — CID 84745099

IUPAC6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2cccc(Cl)c2)n2cc(Br)ccc12
InChIInChI=1S/C14H8BrClN2O/c15-10-4-5-13-12(8-19)17-14(18(13)7-10)9-2-1-3-11(16)6-9/h1-8H
InChIKeyRBACUHMELKXCEI-UHFFFAOYSA-N
MW335.59 g/mol
LogP4.23
Rot. Bonds2

About 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde

6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 84745099) has the molecular formula C14H8BrClN2O and a molecular weight of 335.59 g/mol. Its IUPAC name is 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID84745099
Molecular FormulaC14H8BrClN2O
Molecular Weight335.59 g/mol
Exact Mass333.95
IUPAC Name6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESO=Cc1nc(-c2cccc(Cl)c2)n2cc(Br)ccc12
InChIInChI=1S/C14H8BrClN2O/c15-10-4-5-13-12(8-19)17-14(18(13)7-10)9-2-1-3-11(16)6-9/h1-8H
InChIKeyRBACUHMELKXCEI-UHFFFAOYSA-N
XLogP4.23
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.59
LogP ≤ 54.23
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

7-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745096
6-chloro-3-phenylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84742339
3-(3-bromophenyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745250
6-chloro-3-pyridin-3-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84742426
3-(3-bromophenyl)-7-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745254
6-bromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743817
6-bromo-3-(methylaminomethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743003
1-bromo-6-(3-chlorophenyl)-3-methylimidazo[1,5-a]pyridine
CID 117001352
1-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine
CID 28798071
6-bromo-3-(3-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 84745078
3-(4-bromophenyl)-7-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745253
3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 82483282

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde (CID 84745099) is 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is O=Cc1nc(-c2cccc(Cl)c2)n2cc(Br)ccc12.
What is the InChIKey of 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is RBACUHMELKXCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrClN2O/c15-10-4-5-13-12(8-19)17-14(18(13)7-10)9-2-1-3-11(16)6-9/h1-8H.
What are the key properties of 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 335.59 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(3-chlorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 84745099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).