N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide

C18H17FN2O3 — CID 110367297

IUPACN-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide
SMILESO=C(NCC1CN(c2ccc(F)cc2)C(=O)CO1)c1ccccc1
InChIInChI=1S/C18H17FN2O3/c19-14-6-8-15(9-7-14)21-11-16(24-12-17(21)22)10-20-18(23)13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,20,23)
InChIKeyWUPOEUZGCLJLFI-UHFFFAOYSA-N
MW328.34 g/mol
LogP1.99
Rot. Bonds4

About N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide

N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide (PubChem CID 110367297) has the molecular formula C18H17FN2O3 and a molecular weight of 328.34 g/mol. Its IUPAC name is N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide
PubChem CID110367297
Molecular FormulaC18H17FN2O3
Molecular Weight328.34 g/mol
Exact Mass328.12
IUPAC NameN-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide
SMILESO=C(NCC1CN(c2ccc(F)cc2)C(=O)CO1)c1ccccc1
InChIInChI=1S/C18H17FN2O3/c19-14-6-8-15(9-7-14)21-11-16(24-12-17(21)22)10-20-18(23)13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,20,23)
InChIKeyWUPOEUZGCLJLFI-UHFFFAOYSA-N
XLogP1.99
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]pyridine-4-carboxamide
CID 110367334
3-methyl-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]benzamide
CID 110366956
2-chloro-N-[(5-oxo-4-phenylmorpholin-2-yl)methyl]benzamide
CID 110366991
4-fluoro-N-[[3-(4-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 16920743
N-[[4-(4-ethylphenyl)-5-oxomorpholin-2-yl]methyl]-4-methylbenzamide
CID 110367703
N-[[4-(4-chlorophenyl)-5-oxomorpholin-2-yl]methyl]-4-propan-2-ylbenzamide
CID 110367409
4-fluoro-N-[[2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]benzamide
CID 21027199
N-[[4-(3,4-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]-2-(4-fluorophenyl)acetamide
CID 110367863
N-[[4-(4-methoxyphenyl)-5-oxomorpholin-2-yl]methyl]-3-methylbenzamide
CID 110367545
N-[[4-(3,4-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]-2-fluorobenzamide
CID 110367849
3-fluoro-N-[[3-(4-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 16920742
4-chloro-N-[[4-(3,4-dimethylphenyl)-5-oxomorpholin-2-yl]methyl]benzamide
CID 110367877

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide?
The IUPAC name of N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide (CID 110367297) is N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide.
What is the SMILES notation for N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide?
The canonical SMILES for N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide is O=C(NCC1CN(c2ccc(F)cc2)C(=O)CO1)c1ccccc1.
What is the InChIKey of N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide?
The InChIKey is WUPOEUZGCLJLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O3/c19-14-6-8-15(9-7-14)21-11-16(24-12-17(21)22)10-20-18(23)13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,20,23).
What are the key properties of N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide?
N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide has a molecular weight of 328.34 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-fluorophenyl)-5-oxomorpholin-2-yl]methyl]benzamide is sourced from PubChem (CID 110367297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).