5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol

C12H9N3O2 — CID 136968536

IUPAC5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol
SMILESNc1cc(-c2ccc(O)c3ncccc23)on1
InChIInChI=1S/C12H9N3O2/c13-11-6-10(17-15-11)7-3-4-9(16)12-8(7)2-1-5-14-12/h1-6,16H,(H2,13,15)
InChIKeyAOTDDPVMTRUSEY-UHFFFAOYSA-N
MW227.22 g/mol
LogP2.18
Rot. Bonds1

About 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol

5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol (PubChem CID 136968536) has the molecular formula C12H9N3O2 and a molecular weight of 227.22 g/mol. Its IUPAC name is 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol.

Molecular Properties

Compound Name5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol
PubChem CID136968536
Molecular FormulaC12H9N3O2
Molecular Weight227.22 g/mol
Exact Mass227.07
IUPAC Name5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol
SMILESNc1cc(-c2ccc(O)c3ncccc23)on1
InChIInChI=1S/C12H9N3O2/c13-11-6-10(17-15-11)7-3-4-9(16)12-8(7)2-1-5-14-12/h1-6,16H,(H2,13,15)
InChIKeyAOTDDPVMTRUSEY-UHFFFAOYSA-N
XLogP2.18
TPSA85.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-amino-1,2-oxazol-5-yl)benzene-1,3-diol
CID 137015300
4-(3-amino-1,2-oxazol-5-yl)-2,3-difluorophenol
CID 137013055
bis(5-phenylquinolin-8-ol);zinc
CID 59818569
5-naphthalen-1-ylquinolin-8-ol;zinc
CID 20606771
5-[4-(aminomethyl)phenyl]quinolin-8-ol
CID 39222299
5-(3-amino-4,5-dimethoxyphenyl)quinolin-8-ol
CID 142849594
CID 6367063
CID 6367063
5-[3-(2-aminoethyl)phenyl]quinolin-8-ol
CID 39225223
5-(dioxaziridin-3-yl)quinolin-8-ol
CID 51371084
6-(3-amino-1,2-oxazol-5-yl)-1,3-benzodioxol-5-ol
CID 136993765
6-(3-amino-1,2-oxazol-5-yl)-1,3-dihydro-2-benzofuran-5-ol
CID 137013109
5-bromoquinolin-8-ol;nickel
CID 175092761

Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol?
The IUPAC name of 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol (CID 136968536) is 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol.
What is the SMILES notation for 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol?
The canonical SMILES for 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol is Nc1cc(-c2ccc(O)c3ncccc23)on1.
What is the InChIKey of 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol?
The InChIKey is AOTDDPVMTRUSEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O2/c13-11-6-10(17-15-11)7-3-4-9(16)12-8(7)2-1-5-14-12/h1-6,16H,(H2,13,15).
What are the key properties of 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol?
5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol has a molecular weight of 227.22 g/mol, XLogP of 2.18, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-1,2-oxazol-5-yl)quinolin-8-ol is sourced from PubChem (CID 136968536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).