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

C6H5N3O — CID 162789117

IUPAC[1,2]oxazolo[3,4-b]pyridin-6-amine
SMILESNc1ccc2conc2n1
InChIInChI=1S/C6H5N3O/c7-5-2-1-4-3-10-9-6(4)8-5/h1-3H,(H2,7,8,9)
InChIKeyPSPCIVUITRNDPS-UHFFFAOYSA-N
MW135.13 g/mol
LogP0.81
Rot. Bonds

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

[1,2]oxazolo[3,4-b]pyridin-6-amine (PubChem CID 162789117) has the molecular formula C6H5N3O and a molecular weight of 135.13 g/mol. Its IUPAC name is [1,2]oxazolo[3,4-b]pyridin-6-amine.

Molecular Properties

Compound Name[1,2]oxazolo[3,4-b]pyridin-6-amine
PubChem CID162789117
Molecular FormulaC6H5N3O
Molecular Weight135.13 g/mol
Exact Mass135.04
IUPAC Name[1,2]oxazolo[3,4-b]pyridin-6-amine
SMILESNc1ccc2conc2n1
InChIInChI=1S/C6H5N3O/c7-5-2-1-4-3-10-9-6(4)8-5/h1-3H,(H2,7,8,9)
InChIKeyPSPCIVUITRNDPS-UHFFFAOYSA-N
XLogP0.81
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.13
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide
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CID 158897445
CID 158897445
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CID 155176084
2-(2-amino-4-chlorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820778
quinoline-2,6-diamine
CID 22018948
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CID 53485506
6-fluoropyridine-2,5-diamine
CID 130865020

Frequently Asked Questions

What is the IUPAC name of [1,2]oxazolo[3,4-b]pyridin-6-amine?
The IUPAC name of [1,2]oxazolo[3,4-b]pyridin-6-amine (CID 162789117) is [1,2]oxazolo[3,4-b]pyridin-6-amine.
What is the SMILES notation for [1,2]oxazolo[3,4-b]pyridin-6-amine?
The canonical SMILES for [1,2]oxazolo[3,4-b]pyridin-6-amine is Nc1ccc2conc2n1.
What is the InChIKey of [1,2]oxazolo[3,4-b]pyridin-6-amine?
The InChIKey is PSPCIVUITRNDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O/c7-5-2-1-4-3-10-9-6(4)8-5/h1-3H,(H2,7,8,9).
What are the key properties of [1,2]oxazolo[3,4-b]pyridin-6-amine?
[1,2]oxazolo[3,4-b]pyridin-6-amine has a molecular weight of 135.13 g/mol, XLogP of 0.81, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2]oxazolo[3,4-b]pyridin-6-amine is sourced from PubChem (CID 162789117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).