2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde

C15H11ClN2O — CID 82529103

IUPAC2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(Cc2ccccc2)nc2c(Cl)cccn12
InChIInChI=1S/C15H11ClN2O/c16-12-7-4-8-18-14(10-19)13(17-15(12)18)9-11-5-2-1-3-6-11/h1-8,10H,9H2
InChIKeyKMFGVLVWDHYKST-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.39
Rot. Bonds3

About 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde

2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 82529103) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID82529103
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde
SMILESO=Cc1c(Cc2ccccc2)nc2c(Cl)cccn12
InChIInChI=1S/C15H11ClN2O/c16-12-7-4-8-18-14(10-19)13(17-15(12)18)9-11-5-2-1-3-6-11/h1-8,10H,9H2
InChIKeyKMFGVLVWDHYKST-UHFFFAOYSA-N
XLogP3.39
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.39
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

8-methyl-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529082
2-[(4-ethylphenyl)methyl]-8-fluoroimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529061
8-chloro-2-naphthalen-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 87886295
2-[(4-ethylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82223320
2-chloro-8-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529691
2-benzyl-8-fluoroimidazo[1,2-a]pyridin-3-amine
CID 82529088
7-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82529905
8-chloro-2-ethylimidazo[1,2-a]pyrazine-3-carbaldehyde
CID 22024515
8-chloro-2-(2-methylpropyl)imidazo[1,2-a]pyridin-3-amine
CID 103095037
8-chloro-2-methyl-3-phenylimidazo[1,2-a]pyridine
CID 103095206
6-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530278
1-(2-benzyl-8-methylimidazo[1,2-a]pyridin-3-yl)-N,N-dimethylmethanamine
CID 82223087

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde (CID 82529103) is 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde is O=Cc1c(Cc2ccccc2)nc2c(Cl)cccn12.
What is the InChIKey of 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is KMFGVLVWDHYKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c16-12-7-4-8-18-14(10-19)13(17-15(12)18)9-11-5-2-1-3-6-11/h1-8,10H,9H2.
What are the key properties of 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde?
2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 270.72 g/mol, XLogP of 3.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-8-chloroimidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 82529103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).