8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine

C12H11N3O — CID 28809292

IUPAC8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine
SMILESCCc1cccc2cc3c(N)noc3nc12
InChIInChI=1S/C12H11N3O/c1-2-7-4-3-5-8-6-9-11(13)15-16-12(9)14-10(7)8/h3-6H,2H2,1H3,(H2,13,15)
InChIKeyXSHZJCOVPQEQKS-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.52
Rot. Bonds1

About 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine

8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine (PubChem CID 28809292) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine.

Molecular Properties

Compound Name8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine
PubChem CID28809292
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine
SMILESCCc1cccc2cc3c(N)noc3nc12
InChIInChI=1S/C12H11N3O/c1-2-7-4-3-5-8-6-9-11(13)15-16-12(9)14-10(7)8/h3-6H,2H2,1H3,(H2,13,15)
InChIKeyXSHZJCOVPQEQKS-UHFFFAOYSA-N
XLogP2.52
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,8-diethylquinolin-2-amine
CID 17039687
3,8-diethylquinolin-2-amine;hydrochloride
CID 43866005
8-ethyl-3-methylquinolin-2-amine;hydrochloride
CID 43866070
9-ethyl-2-propan-2-ylpyrimido[4,5-b]quinolin-4-amine
CID 84640203
2-amino-9-ethyl-3H-pyrimido[4,5-b]quinolin-4-one
CID 136866367
carbon dioxide;5-ethyl-6-methyl-[1,2]oxazolo[5,4-b]pyridin-3-amine
CID 162110505
6,8-dimethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine
CID 28809276
3,8-diethyl-N-methylquinolin-2-amine
CID 63232457
3-methyl-8-propylquinolin-2-amine
CID 63232824
3-tert-butyl-2-chloro-8-ethylquinoline
CID 63382109
4-ethylanthracen-9-amine
CID 23131445
2-chloro-8-ethyl-3-propan-2-ylquinoline
CID 63531228

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine?
The IUPAC name of 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine (CID 28809292) is 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine.
What is the SMILES notation for 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine?
The canonical SMILES for 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine is CCc1cccc2cc3c(N)noc3nc12.
What is the InChIKey of 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine?
The InChIKey is XSHZJCOVPQEQKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-2-7-4-3-5-8-6-9-11(13)15-16-12(9)14-10(7)8/h3-6H,2H2,1H3,(H2,13,15).
What are the key properties of 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine?
8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine has a molecular weight of 213.24 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-[1,2]oxazolo[5,4-b]quinolin-3-amine is sourced from PubChem (CID 28809292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).