3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one

C6H5N3O2 — CID 123413936

IUPAC3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one
SMILESNn1c(=O)oc2cccnc21
InChIInChI=1S/C6H5N3O2/c7-9-5-4(11-6(9)10)2-1-3-8-5/h1-3H,7H2
InChIKeySDWJOXHIZKFDRY-UHFFFAOYSA-N
MW151.12 g/mol
LogP-0.30
Rot. Bonds

About 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one

3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one (PubChem CID 123413936) has the molecular formula C6H5N3O2 and a molecular weight of 151.12 g/mol. Its IUPAC name is 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one
PubChem CID123413936
Molecular FormulaC6H5N3O2
Molecular Weight151.12 g/mol
Exact Mass151.04
IUPAC Name3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one
SMILESNn1c(=O)oc2cccnc21
InChIInChI=1S/C6H5N3O2/c7-9-5-4(11-6(9)10)2-1-3-8-5/h1-3H,7H2
InChIKeySDWJOXHIZKFDRY-UHFFFAOYSA-N
XLogP-0.30
TPSA74.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.12
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1-aminopropan-2-yl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 82143832
3-(pyridin-2-ylmethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 75509161
3-(4-methylphenyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 13314020
5-(2-oxo-[1,3]oxazolo[4,5-b]pyridin-3-yl)pentanamide
CID 66921889
3,6-diamino-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 123568857
2-fluoro-2-(2-oxo-[1,3]oxazolo[4,5-b]pyridin-3-yl)acetic acid
CID 81297346
3-amino-1,3-benzoxazol-2-one
CID 11412466
3-[[4-(hydroxymethyl)phenyl]methyl]-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 110006022
3-pent-4-ynyl-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 115872228
3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 3072034
2-(2-oxo-[1,3]oxazolo[4,5-b]pyridin-3-yl)butanoic acid
CID 82060173
3-[3-(4-pentylpiperazin-1-yl)propyl]-[1,3]oxazolo[4,5-b]pyridin-2-one
CID 67898464

Frequently Asked Questions

What is the IUPAC name of 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one?
The IUPAC name of 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one (CID 123413936) is 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one is Nn1c(=O)oc2cccnc21.
What is the InChIKey of 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one?
The InChIKey is SDWJOXHIZKFDRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O2/c7-9-5-4(11-6(9)10)2-1-3-8-5/h1-3H,7H2.
What are the key properties of 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one?
3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one has a molecular weight of 151.12 g/mol, XLogP of -0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-[1,3]oxazolo[4,5-b]pyridin-2-one is sourced from PubChem (CID 123413936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).