N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide

C18H19FN2O2 — CID 674229

IUPACN-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C18H19FN2O2/c19-16-2-1-3-17(12-16)20-18(22)15-6-4-14(5-7-15)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22)
InChIKeyMBCXPFHMKOISCM-UHFFFAOYSA-N
MW314.36 g/mol
LogP2.91
Rot. Bonds4

About N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide

N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide (PubChem CID 674229) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
PubChem CID674229
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
SMILESO=C(Nc1cccc(F)c1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C18H19FN2O2/c19-16-2-1-3-17(12-16)20-18(22)15-6-4-14(5-7-15)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22)
InChIKeyMBCXPFHMKOISCM-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

N-(3-fluorophenyl)-4-(pyrrolidin-1-ylmethyl)benzamide
CID 19062870
N-(3-fluorophenyl)-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 20950886
N-[3-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethylsulfanyl)benzamide
CID 47776622
N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide
CID 108731001
4-(morpholin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2211000
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306
N-(3-amino-4-methylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 141217445
N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 1099911
2,5-difluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 78802644
2,4-difluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 108731005
dimethyl 5-[[4-(morpholin-4-ylmethyl)benzoyl]amino]benzene-1,3-dicarboxylate
CID 9045335
4-ethyl-N-[N-(3-fluorophenyl)-N'-(2-morpholin-4-ylethyl)carbamimidoyl]benzamide
CID 50819647

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide?
The IUPAC name of N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide (CID 674229) is N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide?
The canonical SMILES for N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide is O=C(Nc1cccc(F)c1)c1ccc(CN2CCOCC2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide?
The InChIKey is MBCXPFHMKOISCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-16-2-1-3-17(12-16)20-18(22)15-6-4-14(5-7-15)13-21-8-10-23-11-9-21/h1-7,12H,8-11,13H2,(H,20,22).
What are the key properties of N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide?
N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)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 N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide is sourced from PubChem (CID 674229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).