(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone

C15H16N2O3 — CID 652190

IUPAC(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone
SMILESCc1onc(-c2ccccc2)c1C(=O)N1CCOCC1
InChIInChI=1S/C15H16N2O3/c1-11-13(15(18)17-7-9-19-10-8-17)14(16-20-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
InChIKeyLDDQAAWRCJFDEG-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.12
Rot. Bonds2

About (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone

(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone (PubChem CID 652190) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone
PubChem CID652190
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone
SMILESCc1onc(-c2ccccc2)c1C(=O)N1CCOCC1
InChIInChI=1S/C15H16N2O3/c1-11-13(15(18)17-7-9-19-10-8-17)14(16-20-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
InChIKeyLDDQAAWRCJFDEG-UHFFFAOYSA-N
XLogP2.12
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-3,6-diphenylisoxazolo[4,5-c]pyridin-4(5H)-one
CID 4250909
3-(2-Chlorophenyl)-5-methylisoxazol-4-yl 4-methylpiperazinyl ketone
CID 798832
Morpholin-4-yl-(5-p-tolyl-isoxazol-3-yl)-methanone
CID 1093793
[3-(2-Chloro-phenyl)-5-methyl-isoxazol-4-yl]-piperidin-1-yl-methanone
CID 700029
[3-(2,6-Dichloro-phenyl)-5-methyl-isoxazol-4-yl]-piperidin-1-yl-methanone
CID 743794
(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
CID 822394
5-methyl-3-phenyl-6-(p-[dimethylaminomethyl]phenyl)-isoxazolo[4,5-c]pyridin-4(5H)-one
CID 334509
Mls003170801
CID 332790
Azepan-1-yl-[3-(2-chloro-phenyl)-5-methyl-isoxazol-4-yl]-methanone
CID 717954
Cambridge id 5777587
CID 869900
[2-(4-Methylpiperidin-1-yl)-2-oxoethyl] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
CID 2481042
4-[3-(2-Chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]piperazine-1-carbaldehyde
CID 3555310

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone (CID 652190) is (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone is Cc1onc(-c2ccccc2)c1C(=O)N1CCOCC1.
What is the InChIKey of (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone?
The InChIKey is LDDQAAWRCJFDEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-11-13(15(18)17-7-9-19-10-8-17)14(16-20-11)12-5-3-2-4-6-12/h2-6H,7-10H2,1H3.
What are the key properties of (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone?
(5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone has a molecular weight of 272.30 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-phenyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 652190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).