4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide

C15H19FN2O3 — CID 83101284

IUPAC4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1CC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C15H19FN2O3/c1-17-15(20)14-10-21-7-6-18(14)9-13(19)8-11-2-4-12(16)5-3-11/h2-5,14H,6-10H2,1H3,(H,17,20)
InChIKeyWBKQMVSOAGJVIS-UHFFFAOYSA-N
MW294.33 g/mol
LogP0.38
Rot. Bonds5

About 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide

4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide (PubChem CID 83101284) has the molecular formula C15H19FN2O3 and a molecular weight of 294.33 g/mol. Its IUPAC name is 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide
PubChem CID83101284
Molecular FormulaC15H19FN2O3
Molecular Weight294.33 g/mol
Exact Mass294.14
IUPAC Name4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1CC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C15H19FN2O3/c1-17-15(20)14-10-21-7-6-18(14)9-13(19)8-11-2-4-12(16)5-3-11/h2-5,14H,6-10H2,1H3,(H,17,20)
InChIKeyWBKQMVSOAGJVIS-UHFFFAOYSA-N
XLogP0.38
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide (CID 83101284) is 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide is CNC(=O)C1COCCN1CC(=O)Cc1ccc(F)cc1.
What is the InChIKey of 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide?
The InChIKey is WBKQMVSOAGJVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O3/c1-17-15(20)14-10-21-7-6-18(14)9-13(19)8-11-2-4-12(16)5-3-11/h2-5,14H,6-10H2,1H3,(H,17,20).
What are the key properties of 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide?
4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide has a molecular weight of 294.33 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-fluorophenyl)-2-oxopropyl]-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83101284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).