3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide

C18H19FN2O2 — CID 851469

IUPAC3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(CN2CCOCC2)cc1)c1cccc(F)c1
InChIInChI=1S/C18H19FN2O2/c19-16-3-1-2-15(12-16)18(22)20-17-6-4-14(5-7-17)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22)
InChIKeyCIPVTEGHZRBICN-UHFFFAOYSA-N
MW314.36 g/mol
LogP2.91
Rot. Bonds4

About 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide

3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide (PubChem CID 851469) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
PubChem CID851469
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(CN2CCOCC2)cc1)c1cccc(F)c1
InChIInChI=1S/C18H19FN2O2/c19-16-3-1-2-15(12-16)18(22)20-17-6-4-14(5-7-17)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22)
InChIKeyCIPVTEGHZRBICN-UHFFFAOYSA-N
XLogP2.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Benzyl-2-(dimethylamino)-1-(4-(morpholin-4-yl)phenyl)butan-1-one
CID 86171
2-Amino-N-[3-(morpholin-4-yl)propyl]benzamide
CID 2306528
4-Morpholineacetamide, N-(2-((phenylamino)carbonyl)phenyl)-
CID 217304
4-Morpholinobenzophenone
CID 90600
(S)-N-[1-(3-morpholin-4-yl-phenyl)-ethyl]-3-phenyl-acrylamide
CID 9949648
N-(cyanomethyl)-4-methyl-2-{3-[4-(morpholin-4-yl)phenyl]phenyl}pentanamide
CID 11014664
2-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-13-yl}acetamide
CID 11257357
4-(morpholin-4-yl)-N-{8-oxo-9-azatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-14-yl}butanamide
CID 11338625
N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}-4-(morpholin-4-yl)benzamide
CID 11501571
N-[4-(4-Phenyl-piperazin-1-yl)-butyl]-benzamide
CID 14162480
2-fluoro-N-(2-{[2-(morpholin-4-yl)ethyl]carbamoyl}phenyl)benzamide
CID 24824960
4-{[4-(acetylamino)phenyl][1-(4-fluorobenzyl)piperidin 4 ylidene]methyl}-N,N-diethylbenzamide
CID 11283686

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide?
The IUPAC name of 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide (CID 851469) is 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide?
The canonical SMILES for 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide is O=C(Nc1ccc(CN2CCOCC2)cc1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide?
The InChIKey is CIPVTEGHZRBICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-16-3-1-2-15(12-16)18(22)20-17-6-4-14(5-7-17)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22).
What are the key properties of 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide?
3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide has a molecular weight of 314.36 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide is sourced from PubChem (CID 851469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).