2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine

C17H17N3O3 — CID 44554800

IUPAC2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine
SMILESCOc1ccc(-c2nc3ccc(N4CCOCC4)nc3o2)cc1
InChIInChI=1S/C17H17N3O3/c1-21-13-4-2-12(3-5-13)16-18-14-6-7-15(19-17(14)23-16)20-8-10-22-11-9-20/h2-7H,8-11H2,1H3
InChIKeyIOULECVSTOGKGA-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.73
Rot. Bonds3

About 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine

2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine (PubChem CID 44554800) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine
PubChem CID44554800
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC Name2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine
SMILESCOc1ccc(-c2nc3ccc(N4CCOCC4)nc3o2)cc1
InChIInChI=1S/C17H17N3O3/c1-21-13-4-2-12(3-5-13)16-18-14-6-7-15(19-17(14)23-16)20-8-10-22-11-9-20/h2-7H,8-11H2,1H3
InChIKeyIOULECVSTOGKGA-UHFFFAOYSA-N
XLogP2.73
TPSA60.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-(azepan-1-yl)-2-phenyl-[1,3]oxazolo[5,4-b]pyridine
CID 71256258
5-chloro-2-(4-chlorophenyl)-[1,3]oxazolo[5,4-b]pyridine;2-(4-chlorophenyl)-5-pyrrolidin-1-yl-[1,3]oxazolo[5,4-b]pyridine;methane
CID 159452548
4-[4,6-bis[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine
CID 10076145
5-chloro-2-phenyl-[1,3]oxazolo[5,4-b]pyridine;2-phenyl-5-piperidin-1-yl-[1,3]oxazolo[5,4-b]pyridine
CID 161077471
3-(4-methoxyphenyl)-1-methyl-4-morpholin-4-ylpyrrole-2,5-dione
CID 110556352
2-methyl-6-morpholin-4-ylpyridine-3-carbaldehyde
CID 102544177
4-[4-(4-methoxyphenyl)phthalazin-1-yl]morpholine
CID 6401297
N-[2-(4-methoxyphenoxy)ethyl]-4-methyl-6-morpholin-4-ylpyrimidin-2-amine
CID 112912114
4-[4-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]phenyl]sulfonylmorpholine
CID 3570882
2-(3-fluorophenyl)-5-piperidin-1-yl-[1,3]oxazolo[5,4-b]pyridine
CID 71256288
6-methoxy-2-piperidin-1-ylquinoline
CID 143398989
2-(4-methoxyphenyl)-5-piperidin-1-yl-1,3,4-oxadiazole
CID 135040543

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine?
The IUPAC name of 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine (CID 44554800) is 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine?
The canonical SMILES for 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine is COc1ccc(-c2nc3ccc(N4CCOCC4)nc3o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine?
The InChIKey is IOULECVSTOGKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-21-13-4-2-12(3-5-13)16-18-14-6-7-15(19-17(14)23-16)20-8-10-22-11-9-20/h2-7H,8-11H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine?
2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine has a molecular weight of 311.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-morpholin-4-yl-[1,3]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 44554800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).