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

C9H11N3O — CID 83859361

IUPAC2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine
SMILESCC(CN)c1nc2ncccc2o1
InChIInChI=1S/C9H11N3O/c1-6(5-10)9-12-8-7(13-9)3-2-4-11-8/h2-4,6H,5,10H2,1H3
InChIKeyJOUGKFNCLNFRPY-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.28
Rot. Bonds2

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

2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine (PubChem CID 83859361) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine
PubChem CID83859361
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine
SMILESCC(CN)c1nc2ncccc2o1
InChIInChI=1S/C9H11N3O/c1-6(5-10)9-12-8-7(13-9)3-2-4-11-8/h2-4,6H,5,10H2,1H3
InChIKeyJOUGKFNCLNFRPY-UHFFFAOYSA-N
XLogP1.28
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propanenitrile
CID 83859301
3-amino-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)propanoic acid
CID 116990309
[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol
CID 83383622
N'-methyl-N'-([1,3]oxazolo[4,5-b]pyridin-2-yl)ethane-1,2-diamine
CID 83830097
N-[2-([1,3]oxazolo[4,5-b]pyridin-2-ylsulfanyl)ethyl]-N-propan-2-ylpropan-2-amine
CID 15035818
2-(5-propan-2-yl-3-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine
CID 89434393
ethane;2-phenyl-[1,3]oxazolo[4,5-b]pyridine
CID 91297789
2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol
CID 83384567
[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]methanamine
CID 22754802
2-[(1R)-1-aminoethyl]pyrido[2,3-d][1,3]oxazin-4-one
CID 130673898
2-pyridin-2-ylpropan-1-amine
CID 21481533
2,6-dibromo-4-([1,3]oxazolo[4,5-b]pyridin-2-yl)aniline
CID 17274028

Frequently Asked Questions

What is the IUPAC name of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine?
The IUPAC name of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine (CID 83859361) is 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine.
What is the SMILES notation for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine?
The canonical SMILES for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine is CC(CN)c1nc2ncccc2o1.
What is the InChIKey of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine?
The InChIKey is JOUGKFNCLNFRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-6(5-10)9-12-8-7(13-9)3-2-4-11-8/h2-4,6H,5,10H2,1H3.
What are the key properties of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine?
2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine has a molecular weight of 177.21 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-1-amine is sourced from PubChem (CID 83859361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).