7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde

C10H9N3O2 — CID 84671363

IUPAC7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde
SMILESO=Cc1nc2c(NC3CC3)ccnc2o1
InChIInChI=1S/C10H9N3O2/c14-5-8-13-9-7(12-6-1-2-6)3-4-11-10(9)15-8/h3-6H,1-2H2,(H,11,12)
InChIKeyGIGIPZAXWOLROH-UHFFFAOYSA-N
MW203.20 g/mol
LogP1.61
Rot. Bonds3

About 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde

7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde (PubChem CID 84671363) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde
PubChem CID84671363
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde
SMILESO=Cc1nc2c(NC3CC3)ccnc2o1
InChIInChI=1S/C10H9N3O2/c14-5-8-13-9-7(12-6-1-2-6)3-4-11-10(9)15-8/h3-6H,1-2H2,(H,11,12)
InChIKeyGIGIPZAXWOLROH-UHFFFAOYSA-N
XLogP1.61
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde?
The IUPAC name of 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde (CID 84671363) is 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde.
What is the SMILES notation for 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde?
The canonical SMILES for 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde is O=Cc1nc2c(NC3CC3)ccnc2o1.
What is the InChIKey of 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde?
The InChIKey is GIGIPZAXWOLROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-5-8-13-9-7(12-6-1-2-6)3-4-11-10(9)15-8/h3-6H,1-2H2,(H,11,12).
What are the key properties of 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde?
7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde has a molecular weight of 203.20 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylamino)-[1,3]oxazolo[5,4-b]pyridine-2-carbaldehyde is sourced from PubChem (CID 84671363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).