(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

C19H22N2O5 — CID 18199540

IUPAC(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate
SMILESCCc1noc(C)c1C(=O)OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C19H22N2O5/c1-3-15-16(13(2)26-20-15)19(23)25-17(14-7-5-4-6-8-14)18(22)21-9-11-24-12-10-21/h4-8,17H,3,9-12H2,1-2H3
InChIKeyCOJUQWJNOCOMAP-UHFFFAOYSA-N
MW358.39 g/mol
LogP2.30
Rot. Bonds5

About (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate

(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate (PubChem CID 18199540) has the molecular formula C19H22N2O5 and a molecular weight of 358.39 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate
PubChem CID18199540
Molecular FormulaC19H22N2O5
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate
SMILESCCc1noc(C)c1C(=O)OC(C(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C19H22N2O5/c1-3-15-16(13(2)26-20-15)19(23)25-17(14-7-5-4-6-8-14)18(22)21-9-11-24-12-10-21/h4-8,17H,3,9-12H2,1-2H3
InChIKeyCOJUQWJNOCOMAP-UHFFFAOYSA-N
XLogP2.30
TPSA81.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate?
The IUPAC name of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate (CID 18199540) is (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate.
What is the SMILES notation for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate?
The canonical SMILES for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate is CCc1noc(C)c1C(=O)OC(C(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate?
The InChIKey is COJUQWJNOCOMAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5/c1-3-15-16(13(2)26-20-15)19(23)25-17(14-7-5-4-6-8-14)18(22)21-9-11-24-12-10-21/h4-8,17H,3,9-12H2,1-2H3.
What are the key properties of (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate?
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate has a molecular weight of 358.39 g/mol, XLogP of 2.30, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxo-1-phenylethyl) 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate is sourced from PubChem (CID 18199540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).