4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide

C18H17FN2O3 — CID 895439

IUPAC4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C18H17FN2O3/c19-14-7-5-13(6-8-14)17(22)20-16-4-2-1-3-15(16)18(23)21-9-11-24-12-10-21/h1-8H,9-12H2,(H,20,22)
InChIKeyBBXJHSFGGXVURG-UHFFFAOYSA-N
MW328.34 g/mol
LogP2.55
Rot. Bonds3

About 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide

4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide (PubChem CID 895439) has the molecular formula C18H17FN2O3 and a molecular weight of 328.34 g/mol. Its IUPAC name is 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
PubChem CID895439
Molecular FormulaC18H17FN2O3
Molecular Weight328.34 g/mol
Exact Mass328.12
IUPAC Name4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C18H17FN2O3/c19-14-7-5-13(6-8-14)17(22)20-16-4-2-1-3-15(16)18(23)21-9-11-24-12-10-21/h1-8H,9-12H2,(H,20,22)
InChIKeyBBXJHSFGGXVURG-UHFFFAOYSA-N
XLogP2.55
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide (CID 895439) is 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide is O=C(Nc1ccccc1C(=O)N1CCOCC1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide?
The InChIKey is BBXJHSFGGXVURG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O3/c19-14-7-5-13(6-8-14)17(22)20-16-4-2-1-3-15(16)18(23)21-9-11-24-12-10-21/h1-8H,9-12H2,(H,20,22).
What are the key properties of 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide?
4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide has a molecular weight of 328.34 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(morpholine-4-carbonyl)phenyl]benzamide is sourced from PubChem (CID 895439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).