3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide

C21H25FN2O3 — CID 55612328

IUPAC3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cccc(OCc2ccc(F)cc2)c1)N1CCOCC1
InChIInChI=1S/C21H25FN2O3/c1-16(24-9-11-26-12-10-24)14-23-21(25)18-3-2-4-20(13-18)27-15-17-5-7-19(22)8-6-17/h2-8,13,16H,9-12,14-15H2,1H3,(H,23,25)
InChIKeyOSHOVHTYGGNLMD-UHFFFAOYSA-N
MW372.44 g/mol
LogP2.86
Rot. Bonds7

About 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide

3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide (PubChem CID 55612328) has the molecular formula C21H25FN2O3 and a molecular weight of 372.44 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide
PubChem CID55612328
Molecular FormulaC21H25FN2O3
Molecular Weight372.44 g/mol
Exact Mass372.18
IUPAC Name3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cccc(OCc2ccc(F)cc2)c1)N1CCOCC1
InChIInChI=1S/C21H25FN2O3/c1-16(24-9-11-26-12-10-24)14-23-21(25)18-3-2-4-20(13-18)27-15-17-5-7-19(22)8-6-17/h2-8,13,16H,9-12,14-15H2,1H3,(H,23,25)
InChIKeyOSHOVHTYGGNLMD-UHFFFAOYSA-N
XLogP2.86
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.44
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide?
The IUPAC name of 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide (CID 55612328) is 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide.
What is the SMILES notation for 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide?
The canonical SMILES for 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide is CC(CNC(=O)c1cccc(OCc2ccc(F)cc2)c1)N1CCOCC1.
What is the InChIKey of 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide?
The InChIKey is OSHOVHTYGGNLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O3/c1-16(24-9-11-26-12-10-24)14-23-21(25)18-3-2-4-20(13-18)27-15-17-5-7-19(22)8-6-17/h2-8,13,16H,9-12,14-15H2,1H3,(H,23,25).
What are the key properties of 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide?
3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide has a molecular weight of 372.44 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide is sourced from PubChem (CID 55612328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).