6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine

C7H7N3O2 — CID 83668453

IUPAC6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine
SMILESCOc1ccc2c(N)noc2n1
InChIInChI=1S/C7H7N3O2/c1-11-5-3-2-4-6(8)10-12-7(4)9-5/h2-3H,1H3,(H2,8,10)
InChIKeyJBFROJLIVMFCCS-UHFFFAOYSA-N
MW165.15 g/mol
LogP0.81
Rot. Bonds1

About 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine

6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine (PubChem CID 83668453) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine.

Molecular Properties

Compound Name6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine
PubChem CID83668453
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine
SMILESCOc1ccc2c(N)noc2n1
InChIInChI=1S/C7H7N3O2/c1-11-5-3-2-4-6(8)10-12-7(4)9-5/h2-3H,1H3,(H2,8,10)
InChIKeyJBFROJLIVMFCCS-UHFFFAOYSA-N
XLogP0.81
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine?
The IUPAC name of 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine (CID 83668453) is 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine.
What is the SMILES notation for 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine?
The canonical SMILES for 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine is COc1ccc2c(N)noc2n1.
What is the InChIKey of 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine?
The InChIKey is JBFROJLIVMFCCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c1-11-5-3-2-4-6(8)10-12-7(4)9-5/h2-3H,1H3,(H2,8,10).
What are the key properties of 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine?
6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine has a molecular weight of 165.15 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-[1,2]oxazolo[5,4-b]pyridin-3-amine is sourced from PubChem (CID 83668453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).