3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide

C17H17FN2O2 — CID 898411

IUPAC3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1cccc(F)c1
InChIInChI=1S/C17H17FN2O2/c18-14-5-3-4-13(12-14)17(21)19-15-6-1-2-7-16(15)20-8-10-22-11-9-20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyISIZEZGWUUEMNF-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.91
Rot. Bonds3

About 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide

3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide (PubChem CID 898411) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide
PubChem CID898411
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide
SMILESO=C(Nc1ccccc1N1CCOCC1)c1cccc(F)c1
InChIInChI=1S/C17H17FN2O2/c18-14-5-3-4-13(12-14)17(21)19-15-6-1-2-7-16(15)20-8-10-22-11-9-20/h1-7,12H,8-11H2,(H,19,21)
InChIKeyISIZEZGWUUEMNF-UHFFFAOYSA-N
XLogP2.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide?
The IUPAC name of 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide (CID 898411) is 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide.
What is the SMILES notation for 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide?
The canonical SMILES for 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide is O=C(Nc1ccccc1N1CCOCC1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide?
The InChIKey is ISIZEZGWUUEMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c18-14-5-3-4-13(12-14)17(21)19-15-6-1-2-7-16(15)20-8-10-22-11-9-20/h1-7,12H,8-11H2,(H,19,21).
What are the key properties of 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide?
3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide has a molecular weight of 300.33 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-morpholin-4-ylphenyl)benzamide is sourced from PubChem (CID 898411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).