2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde

C9H7BrN2O — CID 83898362

IUPAC2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde
SMILESO=CCc1cn2ccc(Br)cc2n1
InChIInChI=1S/C9H7BrN2O/c10-7-1-3-12-6-8(2-4-13)11-9(12)5-7/h1,3-6H,2H2
InChIKeyDDMPOBBEQKDHKV-UHFFFAOYSA-N
MW239.07 g/mol
LogP1.84
Rot. Bonds2

About 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde

2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde (PubChem CID 83898362) has the molecular formula C9H7BrN2O and a molecular weight of 239.07 g/mol. Its IUPAC name is 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde.

Molecular Properties

Compound Name2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde
PubChem CID83898362
Molecular FormulaC9H7BrN2O
Molecular Weight239.07 g/mol
Exact Mass237.97
IUPAC Name2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde
SMILESO=CCc1cn2ccc(Br)cc2n1
InChIInChI=1S/C9H7BrN2O/c10-7-1-3-12-6-8(2-4-13)11-9(12)5-7/h1,3-6H,2H2
InChIKeyDDMPOBBEQKDHKV-UHFFFAOYSA-N
XLogP1.84
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.07
LogP ≤ 51.84
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-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetohydrazide
CID 82529989
N-[(7-bromoimidazo[1,2-a]pyridin-2-yl)methyl]cyclopropanamine
CID 117256313
tert-butyl (2S)-2-amino-3-(7-bromoimidazo[1,2-a]pyridin-2-yl)propanoate
CID 167356473
2-(4-bromo-2-pyridinyl)acetaldehyde
CID 53403630
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117135256
2-benzylimidazo[1,2-a]pyridine-7-carbaldehyde
CID 117134926
2-(bromomethyl)-7-iodoimidazo[1,2-a]pyridine;hydrobromide
CID 135397575
2-bromo-1-(2-bromoimidazo[1,2-a]pyridin-7-yl)ethanone
CID 166055094
N-[4-[(7-bromoimidazo[1,2-a]pyridin-2-yl)methylamino]phenyl]-3-piperidin-1-ylpropanamide
CID 154877261
7-bromo-2-(4-nitrophenyl)imidazo[1,2-a]pyridine
CID 45158643
7-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 117133635
7-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine
CID 117135502

Frequently Asked Questions

What is the IUPAC name of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde?
The IUPAC name of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde (CID 83898362) is 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde.
What is the SMILES notation for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde?
The canonical SMILES for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde is O=CCc1cn2ccc(Br)cc2n1.
What is the InChIKey of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde?
The InChIKey is DDMPOBBEQKDHKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2O/c10-7-1-3-12-6-8(2-4-13)11-9(12)5-7/h1,3-6H,2H2.
What are the key properties of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde?
2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde has a molecular weight of 239.07 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)acetaldehyde is sourced from PubChem (CID 83898362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).