4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine

C19H18N2O3 — CID 23656795

IUPAC4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine
SMILESc1ccc(Oc2ccc(-c3cc(N4CCOCC4)on3)cc2)cc1
InChIInChI=1S/C19H18N2O3/c1-2-4-16(5-3-1)23-17-8-6-15(7-9-17)18-14-19(24-20-18)21-10-12-22-13-11-21/h1-9,14H,10-13H2
InChIKeyQCUWZEDNSFYDMG-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.97
Rot. Bonds4

About 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine

4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine (PubChem CID 23656795) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine.

Molecular Properties

Compound Name4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine
PubChem CID23656795
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine
SMILESc1ccc(Oc2ccc(-c3cc(N4CCOCC4)on3)cc2)cc1
InChIInChI=1S/C19H18N2O3/c1-2-4-16(5-3-1)23-17-8-6-15(7-9-17)18-14-19(24-20-18)21-10-12-22-13-11-21/h1-9,14H,10-13H2
InChIKeyQCUWZEDNSFYDMG-UHFFFAOYSA-N
XLogP3.97
TPSA47.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-{4-[5-(4-Ethoxyphenyl)isoxazol-3-yl]butanoyl}-4-(4-methoxyphenyl)piperazine
CID 5309100
5-[(Z)-1-azabicyclo[2.2.2]octan-3-ylidenemethyl]-3-[4-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole
CID 15485015
6-(4-methoxyphenyl)-5-methyl-3-phenylisoxazolo[4,5-c]pyridin-4(5H)-one
CID 20304994
3-(4-methoxyphenyl)-5-methyl-6-phenylisoxazolo[4,5-c]pyridin-4(5H)-one
CID 20305061
[2-[(3,5-Dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone
CID 25163087
5-[(E)-1-azabicyclo[2.2.2]octan-3-ylidenemethyl]-3-[4-[(4-methoxyphenyl)methoxy]phenyl]-1,2-oxazole
CID 44327263
[4-(2-Methoxy-phenyl)-piperazin-1-yl]-(5-phenyl-isoxazol-3-yl)-methanone
CID 1093741
N-{[3-(4-methoxyphenyl)-5-isoxazolyl]methyl}-2-(4-methylpiperazino)acetamide
CID 1480152
1-[4-[4-[4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methoxy]benzoyl]piperazin-1-yl]phenyl]ethanone
CID 2524389
4-ethoxy-N-(3-phenyl-1,2-oxazol-5-yl)benzamide
CID 16013475
5-methyl-3-phenyl-6-(4-propoxyphenyl)isoxazolo[4,5-c]pyridin-4(5H)-one
CID 42601150
1-[4-(2,5-Dimethylphenyl)piperazino]-3-[3-(4-methoxyphenyl)isoxazol-5-yl]propan-1-one
CID 44143705

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine?
The IUPAC name of 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine (CID 23656795) is 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine.
What is the SMILES notation for 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine?
The canonical SMILES for 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine is c1ccc(Oc2ccc(-c3cc(N4CCOCC4)on3)cc2)cc1.
What is the InChIKey of 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine?
The InChIKey is QCUWZEDNSFYDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-2-4-16(5-3-1)23-17-8-6-15(7-9-17)18-14-19(24-20-18)21-10-12-22-13-11-21/h1-9,14H,10-13H2.
What are the key properties of 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine?
4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine has a molecular weight of 322.36 g/mol, XLogP of 3.97, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-phenoxyphenyl)-1,2-oxazol-5-yl]morpholine is sourced from PubChem (CID 23656795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).