N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide

C19H19F3N2O2 — CID 108731001

IUPACN-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c20-19(21,22)16-5-3-15(4-6-16)18(25)23-17-7-1-14(2-8-17)13-24-9-11-26-12-10-24/h1-8H,9-13H2,(H,23,25)
InChIKeyWDXQAZABAJCWSV-UHFFFAOYSA-N
MW364.37 g/mol
LogP3.79
Rot. Bonds4

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

N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide (PubChem CID 108731001) has the molecular formula C19H19F3N2O2 and a molecular weight of 364.37 g/mol. Its IUPAC name is N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide
PubChem CID108731001
Molecular FormulaC19H19F3N2O2
Molecular Weight364.37 g/mol
Exact Mass364.14
IUPAC NameN-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c20-19(21,22)16-5-3-15(4-6-16)18(25)23-17-7-1-14(2-8-17)13-24-9-11-26-12-10-24/h1-8H,9-13H2,(H,23,25)
InChIKeyWDXQAZABAJCWSV-UHFFFAOYSA-N
XLogP3.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.37
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(morpholin-4-ylmethyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2211000
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306
N-[4-(morpholin-4-ylmethyl)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 86917906
4-methyl-N-[4-(1,4-oxazepan-4-ylmethyl)phenyl]benzamide
CID 166858230
4-(difluoromethylsulfonyl)-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 78829467
N-[4-(1-hydroxy-3-morpholin-4-ylpropyl)phenyl]-4-(trifluoromethyl)benzamide
CID 84558640
N-(3-fluorophenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 674229
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(morpholin-4-ylmethyl)benzamide
CID 126320858
4-morpholin-4-ylsulfonyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 17391128
N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 1099911
N-(3-amino-4-methylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 141217445
4-butan-2-yloxy-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 2940925

Frequently Asked Questions

What is the IUPAC name of N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide?
The IUPAC name of N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide (CID 108731001) is N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide is O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide?
The InChIKey is WDXQAZABAJCWSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O2/c20-19(21,22)16-5-3-15(4-6-16)18(25)23-17-7-1-14(2-8-17)13-24-9-11-26-12-10-24/h1-8H,9-13H2,(H,23,25).
What are the key properties of N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide?
N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide has a molecular weight of 364.37 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 108731001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).