8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde

C7H4BrN3O — CID 84690292

IUPAC8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde
SMILESO=Cc1cn2cncc(Br)c2n1
InChIInChI=1S/C7H4BrN3O/c8-6-1-9-4-11-2-5(3-12)10-7(6)11/h1-4H
InChIKeyYWHIQSATURJSIO-UHFFFAOYSA-N
MW226.03 g/mol
LogP1.30
Rot. Bonds1

About 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde

8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde (PubChem CID 84690292) has the molecular formula C7H4BrN3O and a molecular weight of 226.03 g/mol. Its IUPAC name is 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde.

Molecular Properties

Compound Name8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde
PubChem CID84690292
Molecular FormulaC7H4BrN3O
Molecular Weight226.03 g/mol
Exact Mass224.95
IUPAC Name8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde
SMILESO=Cc1cn2cncc(Br)c2n1
InChIInChI=1S/C7H4BrN3O/c8-6-1-9-4-11-2-5(3-12)10-7(6)11/h1-4H
InChIKeyYWHIQSATURJSIO-UHFFFAOYSA-N
XLogP1.30
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.03
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(8-bromoimidazo[1,2-c]pyrimidin-2-yl)methanamine
CID 84690918
8-chloro-6-fluoroimidazo[1,2-a]pyridine-2-carbaldehyde
CID 91927377
pyrazine-2,6-dicarbaldehyde
CID 23496663
6-hydroxy-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine-2-carbaldehyde
CID 84695513
6-chloro-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbaldehyde
CID 144817336
6-hydroxyimidazo[1,2-a]pyridine-2-carbaldehyde
CID 105431793
6-hydroxy-8-(propan-2-ylamino)imidazo[1,2-a]pyrazine-2-carbaldehyde
CID 84685607
8-piperidin-1-ylimidazo[1,2-a]pyrazine-2-carbaldehyde
CID 84693542
6,8-bis(4-fluorophenyl)imidazo[1,2-b]pyridazine-2-carbaldehyde
CID 144817670
7-chloroimidazo[1,2-a]pyridine-2-carbaldehyde
CID 55266936
8-bromoquinoxaline-2-carbaldehyde
CID 131849321
imidazo[1,2-b][1,2,4]triazine-6-carbaldehyde
CID 58764268

Frequently Asked Questions

What is the IUPAC name of 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde?
The IUPAC name of 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde (CID 84690292) is 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde.
What is the SMILES notation for 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde?
The canonical SMILES for 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde is O=Cc1cn2cncc(Br)c2n1.
What is the InChIKey of 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde?
The InChIKey is YWHIQSATURJSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrN3O/c8-6-1-9-4-11-2-5(3-12)10-7(6)11/h1-4H.
What are the key properties of 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde?
8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde has a molecular weight of 226.03 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromoimidazo[1,2-c]pyrimidine-2-carbaldehyde is sourced from PubChem (CID 84690292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).