(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate

C20H21NO5 — CID 2365991

IUPAC(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate
SMILESO=C(OCC(=O)N1CCOCC1)c1ccccc1OCc1ccccc1
InChIInChI=1S/C20H21NO5/c22-19(21-10-12-24-13-11-21)15-26-20(23)17-8-4-5-9-18(17)25-14-16-6-2-1-3-7-16/h1-9H,10-15H2
InChIKeyLALFJGJYQCZARQ-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.28
Rot. Bonds6

About (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate

(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate (PubChem CID 2365991) has the molecular formula C20H21NO5 and a molecular weight of 355.39 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate
PubChem CID2365991
Molecular FormulaC20H21NO5
Molecular Weight355.39 g/mol
Exact Mass355.14
IUPAC Name(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate
SMILESO=C(OCC(=O)N1CCOCC1)c1ccccc1OCc1ccccc1
InChIInChI=1S/C20H21NO5/c22-19(21-10-12-24-13-11-21)15-26-20(23)17-8-4-5-9-18(17)25-14-16-6-2-1-3-7-16/h1-9H,10-15H2
InChIKeyLALFJGJYQCZARQ-UHFFFAOYSA-N
XLogP2.28
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-morpholin-4-yl-2-oxoethyl) 4-phenylmethoxybenzoate
CID 2607617
(2-morpholin-4-yl-2-oxoethyl) 2-fluorobenzoate
CID 4287540
1-morpholin-4-yl-2-(2-phenylmethoxyanilino)ethanone
CID 54828242
2-amino-3-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid
CID 79778699
[2-(4-benzylpiperazin-1-yl)-2-oxoethyl] 2-(2-amino-2-oxoethoxy)benzoate
CID 55479799
phenacyl 2-phenylmethoxybenzoate
CID 2565163
[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl] 2-[(4-chlorophenyl)methoxy]benzoate
CID 7853325
2-(4-morpholin-4-yl-4-oxobutoxy)benzoic acid
CID 43214310
4-[[2-(morpholine-4-carbonyl)phenoxy]methyl]benzonitrile
CID 17465828
(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate
CID 30471712
[2-[(4-chlorophenyl)methoxy]phenyl]-morpholin-4-ylmethanethione
CID 4291255
[2-(1-adamantyl)-2-oxoethyl] 2-phenylmethoxybenzoate
CID 7718124

Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate?
The IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate (CID 2365991) is (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate.
What is the SMILES notation for (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate?
The canonical SMILES for (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate is O=C(OCC(=O)N1CCOCC1)c1ccccc1OCc1ccccc1.
What is the InChIKey of (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate?
The InChIKey is LALFJGJYQCZARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO5/c22-19(21-10-12-24-13-11-21)15-26-20(23)17-8-4-5-9-18(17)25-14-16-6-2-1-3-7-16/h1-9H,10-15H2.
What are the key properties of (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate?
(2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate has a molecular weight of 355.39 g/mol, XLogP of 2.28, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxoethyl) 2-phenylmethoxybenzoate is sourced from PubChem (CID 2365991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).