4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide

C21H24N2O3 — CID 16894751

IUPAC4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESCCc1ccc(C(=O)NCC(=O)N2CCOC(c3ccccc3)C2)cc1
InChIInChI=1S/C21H24N2O3/c1-2-16-8-10-18(11-9-16)21(25)22-14-20(24)23-12-13-26-19(15-23)17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3,(H,22,25)
InChIKeyCDUMZXMULAFUCJ-UHFFFAOYSA-N
MW352.43 g/mol
LogP2.58
Rot. Bonds5

About 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide

4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide (PubChem CID 16894751) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide
PubChem CID16894751
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESCCc1ccc(C(=O)NCC(=O)N2CCOC(c3ccccc3)C2)cc1
InChIInChI=1S/C21H24N2O3/c1-2-16-8-10-18(11-9-16)21(25)22-14-20(24)23-12-13-26-19(15-23)17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3,(H,22,25)
InChIKeyCDUMZXMULAFUCJ-UHFFFAOYSA-N
XLogP2.58
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-[3-[(2S)-2-phenylmorpholin-4-yl]propyl]benzamide
CID 30851064
N-(4-ethylphenyl)-2-phenylmorpholine-4-carboxamide
CID 84526380
N-[3-oxo-3-[(2R)-2-phenylmorpholin-4-yl]propyl]benzamide
CID 31414440
N-[2-oxo-2-[(2S)-2-phenylmorpholin-4-yl]ethyl]-3-phenylpropanamide
CID 30851130
2,5-dichloro-N-[2-oxo-2-[(2R)-2-phenylmorpholin-4-yl]ethyl]benzamide
CID 30851129
3-(4-methoxyphenyl)-N-[2-oxo-2-[(2S)-2-phenylmorpholin-4-yl]ethyl]propanamide
CID 27375928
1-[2-(4-ethylphenyl)morpholin-4-yl]ethanone
CID 71684128
N-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]benzamide
CID 81209103
1-[2-(4-ethylphenyl)morpholin-4-yl]-4-phenoxybutan-1-one
CID 110364018
N-(1,3-benzodioxol-5-ylmethyl)-N'-[2-oxo-2-[(2S)-2-phenylmorpholin-4-yl]ethyl]oxamide
CID 30851180
5-chloro-2-methoxy-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide
CID 16894767
2,3,4,5,6-pentamethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzenesulfonamide
CID 16895082

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The IUPAC name of 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide (CID 16894751) is 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The canonical SMILES for 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide is CCc1ccc(C(=O)NCC(=O)N2CCOC(c3ccccc3)C2)cc1.
What is the InChIKey of 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The InChIKey is CDUMZXMULAFUCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-2-16-8-10-18(11-9-16)21(25)22-14-20(24)23-12-13-26-19(15-23)17-6-4-3-5-7-17/h3-11,19H,2,12-15H2,1H3,(H,22,25).
What are the key properties of 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide has a molecular weight of 352.43 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]benzamide is sourced from PubChem (CID 16894751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).