2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide

C20H21FN2O3 — CID 16894772

IUPAC2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]acetamide
SMILESC1COC(CN1C(=O)CNC(=O)CC2=CC=C(C=C2)F)C3=CC=CC=C3
InChIInChI=1S/C20H21FN2O3/c21-17-8-6-15(7-9-17)12-19(24)22-13-20(25)23-10-11-26-18(14-23)16-4-2-1-3-5-16/h1-9,18H,10-14H2,(H,22,24)
InChIKeyBNEHDXVNQOWTTP-UHFFFAOYSA-N
MW356.40 g/mol
LogP1.90
Rot. Bonds5

About 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide

2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide (PubChem CID 16894772) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide
PubChem CID16894772
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]acetamide
SMILESC1COC(CN1C(=O)CNC(=O)CC2=CC=C(C=C2)F)C3=CC=CC=C3
InChIInChI=1S/C20H21FN2O3/c21-17-8-6-15(7-9-17)12-19(24)22-13-20(25)23-10-11-26-18(14-23)16-4-2-1-3-5-16/h1-9,18H,10-14H2,(H,22,24)
InChIKeyBNEHDXVNQOWTTP-UHFFFAOYSA-N
XLogP1.90
TPSA58.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity474

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide (CID 16894772) is 2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylmorpholin-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide is C1COC(CN1C(=O)CNC(=O)CC2=CC=C(C=C2)F)C3=CC=CC=C3.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide?
The InChIKey is BNEHDXVNQOWTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c21-17-8-6-15(7-9-17)12-19(24)22-13-20(25)23-10-11-26-18(14-23)16-4-2-1-3-5-16/h1-9,18H,10-14H2,(H,22,24).
What are the key properties of 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide?
2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide has a molecular weight of 356.40 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)acetamide is sourced from PubChem (CID 16894772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).