3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde

C7H4ClN3O — CID 84658223

IUPAC3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde
SMILESO=Cc1nccn2c(Cl)cnc12
InChIInChI=1S/C7H4ClN3O/c8-6-3-10-7-5(4-12)9-1-2-11(6)7/h1-4H
InChIKeyASKRGIFZFWCORH-UHFFFAOYSA-N
MW181.58 g/mol
LogP1.20
Rot. Bonds1

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

3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde (PubChem CID 84658223) has the molecular formula C7H4ClN3O and a molecular weight of 181.58 g/mol. Its IUPAC name is 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde.

Molecular Properties

Compound Name3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde
PubChem CID84658223
Molecular FormulaC7H4ClN3O
Molecular Weight181.58 g/mol
Exact Mass181.00
IUPAC Name3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde
SMILESO=Cc1nccn2c(Cl)cnc12
InChIInChI=1S/C7H4ClN3O/c8-6-3-10-7-5(4-12)9-1-2-11(6)7/h1-4H
InChIKeyASKRGIFZFWCORH-UHFFFAOYSA-N
XLogP1.20
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.58
LogP ≤ 51.20
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

3-chloro-8-piperazin-1-ylimidazo[1,2-a]pyrazine;hydrochloride
CID 12841593
CID 89399008
CID 89399008
2-methylimidazo[1,2-a]pyrazine-8-carbaldehyde
CID 84651184
3,8-dichloro-7-iodoimidazo[1,2-a]pyridine
CID 169177950
3-chloroimidazo[1,2-a]pyrimidine-6-carbaldehyde
CID 83828452
8-chloro-2-ethylimidazo[1,2-a]pyrazine-3-carbaldehyde
CID 22024515
3-chloro-N-[(3R,6R)-6-methylpiperidin-3-yl]imidazo[1,2-a]pyrazin-8-amine
CID 121439863
3-chloroimidazo[1,2-a]pyrimidine
CID 15179743
3,8-dichloro-[1,2,4]triazolo[4,3-a]pyrazine
CID 133054598
8-(propan-2-ylamino)imidazo[1,2-a]pyrazine-3-carbaldehyde
CID 84672327
8-chloro-2H-[1,2,4]triazolo[4,3-a]pyrazine-3-thione
CID 130520880
3-chloropyrazolo[1,5-a]pyrazine-2-carbaldehyde
CID 105439809

Frequently Asked Questions

What is the IUPAC name of 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde?
The IUPAC name of 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde (CID 84658223) is 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde.
What is the SMILES notation for 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde?
The canonical SMILES for 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde is O=Cc1nccn2c(Cl)cnc12.
What is the InChIKey of 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde?
The InChIKey is ASKRGIFZFWCORH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClN3O/c8-6-3-10-7-5(4-12)9-1-2-11(6)7/h1-4H.
What are the key properties of 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde?
3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde has a molecular weight of 181.58 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde is sourced from PubChem (CID 84658223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).