N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide

C19H14F3NO2 — CID 2114391

IUPACN-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(NCc1ccco1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H14F3NO2/c20-19(21,22)14-9-7-13(8-10-14)16-5-1-2-6-17(16)18(24)23-12-15-4-3-11-25-15/h1-11H,12H2,(H,23,24)
InChIKeyXUXFADYSXCDFRJ-UHFFFAOYSA-N
MW345.32 g/mol
LogP4.90
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide

N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 2114391) has the molecular formula C19H14F3NO2 and a molecular weight of 345.32 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID2114391
Molecular FormulaC19H14F3NO2
Molecular Weight345.32 g/mol
Exact Mass345.10
IUPAC NameN-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(NCc1ccco1)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H14F3NO2/c20-19(21,22)14-9-7-13(8-10-14)16-5-1-2-6-17(16)18(24)23-12-15-4-3-11-25-15/h1-11H,12H2,(H,23,24)
InChIKeyXUXFADYSXCDFRJ-UHFFFAOYSA-N
XLogP4.90
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.32
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-Tert-butyl-N-(2-furylmethyl)benzamide
CID 674888
N-(2-Furylmethyl)benzamide
CID 236716
N-(2-Furylmethyl)-3-phenylacrylamide
CID 732131
4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(furan-2-ylmethyl)butanamide
CID 2870264
N-(2-Furanylmethyl)-4-methylbenzamide
CID 674887
N-(furan-2-ylmethyl)naphthalene-2-carboxamide
CID 692689
2-fluoro-N-(2-furylmethyl)benzamide
CID 784948
Benzyl(furan-2-ylmethyl)amine
CID 39338
N-Furfuryl-1-cyclohexanecarboxamide
CID 240161
N-benzylfuran-2-carboxamide
CID 347531
N-(furan-2-ylmethyl)-N-(4-methylbenzyl)-2-[4-(propan-2-yl)phenoxy]acetamide
CID 16013108
2-cyclohexyl-N-(furan-2-ylmethyl)acetamide
CID 806872

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide (CID 2114391) is N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide is O=C(NCc1ccco1)c1ccccc1-c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is XUXFADYSXCDFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO2/c20-19(21,22)14-9-7-13(8-10-14)16-5-1-2-6-17(16)18(24)23-12-15-4-3-11-25-15/h1-11H,12H2,(H,23,24).
What are the key properties of N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide?
N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 345.32 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 2114391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).