N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide

C20H21FN2O3 — CID 47023015

IUPACN-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)N2CCOC(c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C20H21FN2O3/c1-14(24)22-18-8-2-15(3-9-18)12-20(25)23-10-11-26-19(13-23)16-4-6-17(21)7-5-16/h2-9,19H,10-13H2,1H3,(H,22,24)
InChIKeySZSVSMAEJLNEJN-UHFFFAOYSA-N
MW356.40 g/mol
LogP2.93
Rot. Bonds4

About N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide

N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide (PubChem CID 47023015) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide
PubChem CID47023015
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC NameN-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CC(=O)N2CCOC(c3ccc(F)cc3)C2)cc1
InChIInChI=1S/C20H21FN2O3/c1-14(24)22-18-8-2-15(3-9-18)12-20(25)23-10-11-26-19(13-23)16-4-6-17(21)7-5-16/h2-9,19H,10-13H2,1H3,(H,22,24)
InChIKeySZSVSMAEJLNEJN-UHFFFAOYSA-N
XLogP2.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide?
The IUPAC name of N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide (CID 47023015) is N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide?
The canonical SMILES for N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide is CC(=O)Nc1ccc(CC(=O)N2CCOC(c3ccc(F)cc3)C2)cc1.
What is the InChIKey of N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide?
The InChIKey is SZSVSMAEJLNEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-14(24)22-18-8-2-15(3-9-18)12-20(25)23-10-11-26-19(13-23)16-4-6-17(21)7-5-16/h2-9,19H,10-13H2,1H3,(H,22,24).
What are the key properties of N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide?
N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide has a molecular weight of 356.40 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-[2-(4-fluorophenyl)morpholin-4-yl]-2-oxoethyl]phenyl]acetamide is sourced from PubChem (CID 47023015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).