2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde

C15H12N2O — CID 117132555

IUPAC2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde
SMILESO=Cc1cccc2nc(Cc3ccccc3)cn12
InChIInChI=1S/C15H12N2O/c18-11-14-7-4-8-15-16-13(10-17(14)15)9-12-5-2-1-3-6-12/h1-8,10-11H,9H2
InChIKeyYOGQZLPHBPAEOP-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.74
Rot. Bonds3

About 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde

2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde (PubChem CID 117132555) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde.

Molecular Properties

Compound Name2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde
PubChem CID117132555
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde
SMILESO=Cc1cccc2nc(Cc3ccccc3)cn12
InChIInChI=1S/C15H12N2O/c18-11-14-7-4-8-15-16-13(10-17(14)15)9-12-5-2-1-3-6-12/h1-8,10-11H,9H2
InChIKeyYOGQZLPHBPAEOP-UHFFFAOYSA-N
XLogP2.74
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.74
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

2-propan-2-ylimidazo[1,2-a]pyridine-5-carbaldehyde
CID 82405072
2-[(4-chlorophenyl)methyl]-5-methylimidazo[1,2-a]pyridine
CID 117132832
2-benzylimidazo[1,2-a]pyridine-7-carbaldehyde
CID 117134926
2-benzyl-6-bromo-5-methylimidazo[1,2-a]pyridine
CID 115403650
[2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-5-yl]methanamine
CID 117132788
2-[(3-chlorophenyl)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117132642
5-bromo-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine
CID 117132587
1-benzyl-4-[(4-benzylphenyl)methyl]benzene;1,4-dibenzylbenzene;ethane
CID 158067654
1,4-dibenzylbenzene;ethane
CID 91406396
2-(3,5-dimethyl-1H-pyrrol-2-yl)imidazo[1,2-a]pyridine-5-carbaldehyde
CID 82388345
2-[(2-chlorophenyl)methyl]-5-methylimidazo[1,2-a]pyridine
CID 117132716
4-(imidazo[1,2-a]pyridin-2-ylmethyl)benzonitrile
CID 102282894

Frequently Asked Questions

What is the IUPAC name of 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde?
The IUPAC name of 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde (CID 117132555) is 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde.
What is the SMILES notation for 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde?
The canonical SMILES for 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde is O=Cc1cccc2nc(Cc3ccccc3)cn12.
What is the InChIKey of 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde?
The InChIKey is YOGQZLPHBPAEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c18-11-14-7-4-8-15-16-13(10-17(14)15)9-12-5-2-1-3-6-12/h1-8,10-11H,9H2.
What are the key properties of 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde?
2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde has a molecular weight of 236.27 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzylimidazo[1,2-a]pyridine-5-carbaldehyde is sourced from PubChem (CID 117132555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).