2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine

C8H9N3O — CID 84651562

IUPAC2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
SMILESNCCc1cnc2ocnc2c1
InChIInChI=1S/C8H9N3O/c9-2-1-6-3-7-8(10-4-6)12-5-11-7/h3-5H,1-2,9H2
InChIKeyRSDBRFXJVODXPU-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.72
Rot. Bonds2

About 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine

2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine (PubChem CID 84651562) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine.

Molecular Properties

Compound Name2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
PubChem CID84651562
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine
SMILESNCCc1cnc2ocnc2c1
InChIInChI=1S/C8H9N3O/c9-2-1-6-3-7-8(10-4-6)12-5-11-7/h3-5H,1-2,9H2
InChIKeyRSDBRFXJVODXPU-UHFFFAOYSA-N
XLogP0.72
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-[1,3]oxazolo[5,4-b]pyridine
CID 55252688
[1,3]oxazolo[5,4-b]pyridin-6-ol
CID 146568826
2-(3-methylimidazo[4,5-b]pyridin-6-yl)ethanamine
CID 83874573
2-(2,2-diphenyl-[1,3]dioxolo[4,5-b]pyridin-6-yl)ethanamine
CID 170859937
2-(5,6-dimethoxy-3-pyridinyl)ethanamine
CID 66847650
2-quinolin-3-ylethanamine;hydrochloride
CID 68724239
2-[6-methoxy-5-(trifluoromethyl)-3-pyridinyl]ethanamine
CID 167442979
2-(2,3-dimethylimidazo[4,5-b]pyridin-6-yl)ethanamine
CID 83877519
5-(2-aminoethyl)-N,N-dimethylpyrimidin-2-amine
CID 62756266
2-(2-methyl-1H-imidazo[4,5-b]pyridin-6-yl)ethanamine
CID 59533509
(2-ethyl-[1,3]oxazolo[5,4-b]pyridin-6-yl)methanamine
CID 84655981
2-(2,1-benzoxazol-6-yl)ethanamine
CID 84764513

Frequently Asked Questions

What is the IUPAC name of 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The IUPAC name of 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine (CID 84651562) is 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine.
What is the SMILES notation for 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The canonical SMILES for 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine is NCCc1cnc2ocnc2c1.
What is the InChIKey of 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
The InChIKey is RSDBRFXJVODXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c9-2-1-6-3-7-8(10-4-6)12-5-11-7/h3-5H,1-2,9H2.
What are the key properties of 2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine?
2-([1,3]oxazolo[5,4-b]pyridin-6-yl)ethanamine has a molecular weight of 163.18 g/mol, XLogP of 0.72, 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[5,4-b]pyridin-6-yl)ethanamine is sourced from PubChem (CID 84651562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).