2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol

C13H15N3O3 — CID 136963478

IUPAC2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol
SMILESNc1cc(-c2cc(N3CCOCC3)ccc2O)no1
InChIInChI=1S/C13H15N3O3/c14-13-8-11(15-19-13)10-7-9(1-2-12(10)17)16-3-5-18-6-4-16/h1-2,7-8,17H,3-6,14H2
InChIKeyKXZKZJSCFWYBLG-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.47
Rot. Bonds2

About 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol

2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol (PubChem CID 136963478) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol.

Molecular Properties

Compound Name2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol
PubChem CID136963478
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol
SMILESNc1cc(-c2cc(N3CCOCC3)ccc2O)no1
InChIInChI=1S/C13H15N3O3/c14-13-8-11(15-19-13)10-7-9(1-2-12(10)17)16-3-5-18-6-4-16/h1-2,7-8,17H,3-6,14H2
InChIKeyKXZKZJSCFWYBLG-UHFFFAOYSA-N
XLogP1.47
TPSA84.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
CID 137015302
3-(4-fluoro-2-morpholin-4-ylphenyl)-1,2-oxazol-5-amine
CID 115112379
5-(2-hydroxy-5-morpholin-4-ylphenyl)-1-methylpyrazole-3-carboxylic acid
CID 136966493
3-(4-morpholin-4-ylphenyl)-1,2-oxazole-5-carboxamide
CID 68864303
2-chloro-5-morpholin-4-ylphenol
CID 84679971
(3S,4S)-1-[3-[2-amino-6-(2-morpholin-4-ylethoxy)pyrimidin-4-yl]-4-hydroxyphenyl]pyrrolidine-3,4-diol
CID 142669009
3-amino-5-(2-methyl-5-morpholin-4-ylphenyl)phenol
CID 166467816
4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
CID 137012596
3-(2-piperidin-1-ylphenyl)-1,2-oxazol-5-amine
CID 117360434
2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5-methylphenol
CID 136993797
4-morpholin-4-yl-2-propan-2-ylaniline
CID 91671939
4-morpholin-4-ylbenzene-1,2-diamine;sulfuric acid
CID 70192799

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol?
The IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol (CID 136963478) is 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol.
What is the SMILES notation for 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol?
The canonical SMILES for 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol is Nc1cc(-c2cc(N3CCOCC3)ccc2O)no1.
What is the InChIKey of 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol?
The InChIKey is KXZKZJSCFWYBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c14-13-8-11(15-19-13)10-7-9(1-2-12(10)17)16-3-5-18-6-4-16/h1-2,7-8,17H,3-6,14H2.
What are the key properties of 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol?
2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol has a molecular weight of 261.28 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1,2-oxazol-3-yl)-4-morpholin-4-ylphenol is sourced from PubChem (CID 136963478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).