(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate

C20H21NO4 — CID 2999738

IUPAC(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate
SMILESO=C(OCC(=O)N1CCOCC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H21NO4/c22-18(21-11-13-24-14-12-21)15-25-20(23)19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,19H,11-15H2
InChIKeyCVDUWFIRDMIKQP-UHFFFAOYSA-N
MW339.39 g/mol
LogP2.22
Rot. Bonds5

About (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate

(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate (PubChem CID 2999738) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate
PubChem CID2999738
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC Name(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate
SMILESO=C(OCC(=O)N1CCOCC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H21NO4/c22-18(21-11-13-24-14-12-21)15-25-20(23)19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,19H,11-15H2
InChIKeyCVDUWFIRDMIKQP-UHFFFAOYSA-N
XLogP2.22
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate?
The IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate (CID 2999738) is (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate.
What is the SMILES notation for (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate?
The canonical SMILES for (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate is O=C(OCC(=O)N1CCOCC1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate?
The InChIKey is CVDUWFIRDMIKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c22-18(21-11-13-24-14-12-21)15-25-20(23)19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,19H,11-15H2.
What are the key properties of (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate?
(2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate has a molecular weight of 339.39 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxoethyl) 2,2-diphenylacetate is sourced from PubChem (CID 2999738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).