3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one

C12H15N3O3 — CID 3072034

IUPAC3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
SMILESO=c1oc2cccnc2n1CCN1CCOCC1
InChIInChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)11-10(18-12)2-1-3-13-11/h1-3H,4-9H2
InChIKeyFTNDZQVIQZUANZ-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.32
Rot. Bonds3

About 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one

3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one (PubChem CID 3072034) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
PubChem CID3072034
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
SMILESO=c1oc2cccnc2n1CCN1CCOCC1
InChIInChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)11-10(18-12)2-1-3-13-11/h1-3H,4-9H2
InChIKeyFTNDZQVIQZUANZ-UHFFFAOYSA-N
XLogP0.32
TPSA60.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-(4-phenoxyphenyl)-1-piperazinyl)ethyl)-
CID 382817
3-(2-ethylbenzyl)[1,3]oxazolo[4,5-b]pyridin-2(3H)-one
CID 2811801
[1-(5-Methoxy-2-pyridinyl)piperidin-4-yl] 4-propan-2-ylpiperazine-1-carboxylate
CID 89488552
[1-(5-Methoxy-2-pyridinyl)piperidin-4-yl] 4-cyclobutylpiperazine-1-carboxylate
CID 89494554
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(3-(4-phenyl-1-piperazinyl)propyl)-
CID 126108
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-((4-(2-methoxyphenyl)-1-piperazinyl)methyl)-
CID 382816
S 12813
CID 3035655
3-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)oxazolo(4,5-b)pyridin-2(3H)-one
CID 3036067
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(1-piperidinyl)ethyl)-
CID 3072032
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-(2-(4-methyl-1-piperazinyl)ethyl)-
CID 3072033
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-((4-(4-fluorophenyl)-1-piperazinyl)methyl)-
CID 3073120
Oxazolo(4,5-b)pyridin-2(3H)-one, 3-((4-(2-chlorophenyl)-1-piperazinyl)methyl)-
CID 3073123

Frequently Asked Questions

What is the IUPAC name of 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one?
The IUPAC name of 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one (CID 3072034) is 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one is O=c1oc2cccnc2n1CCN1CCOCC1.
What is the InChIKey of 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one?
The InChIKey is FTNDZQVIQZUANZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)11-10(18-12)2-1-3-13-11/h1-3H,4-9H2.
What are the key properties of 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one?
3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one has a molecular weight of 249.27 g/mol, XLogP of 0.32, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-morpholin-4-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one is sourced from PubChem (CID 3072034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).