1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine

C9H9N3O — CID 84766871

IUPAC1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine
SMILESNC1(c2noc3cccnc23)CC1
InChIInChI=1S/C9H9N3O/c10-9(3-4-9)8-7-6(13-12-8)2-1-5-11-7/h1-2,5H,3-4,10H2
InChIKeyMQAWFPCBIMWPGF-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.17
Rot. Bonds1

About 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine

1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine (PubChem CID 84766871) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine
PubChem CID84766871
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine
SMILESNC1(c2noc3cccnc23)CC1
InChIInChI=1S/C9H9N3O/c10-9(3-4-9)8-7-6(13-12-8)2-1-5-11-7/h1-2,5H,3-4,10H2
InChIKeyMQAWFPCBIMWPGF-UHFFFAOYSA-N
XLogP1.17
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine?
The IUPAC name of 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine (CID 84766871) is 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine?
The canonical SMILES for 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine is NC1(c2noc3cccnc23)CC1.
What is the InChIKey of 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine?
The InChIKey is MQAWFPCBIMWPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c10-9(3-4-9)8-7-6(13-12-8)2-1-5-11-7/h1-2,5H,3-4,10H2.
What are the key properties of 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine?
1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine has a molecular weight of 175.19 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,2]oxazolo[4,5-b]pyridin-3-yl)cyclopropan-1-amine is sourced from PubChem (CID 84766871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).