3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

C14H12F3NO2 — CID 8762528

IUPAC3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESO=C(CCc1ccco1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H12F3NO2/c15-14(16,17)10-3-1-4-11(9-10)18-13(19)7-6-12-5-2-8-20-12/h1-5,8-9H,6-7H2,(H,18,19)
InChIKeyYDHFKNKXPJUUTL-UHFFFAOYSA-N
MW283.25 g/mol
LogP3.87
Rot. Bonds4

About 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 8762528) has the molecular formula C14H12F3NO2 and a molecular weight of 283.25 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
PubChem CID8762528
Molecular FormulaC14H12F3NO2
Molecular Weight283.25 g/mol
Exact Mass283.08
IUPAC Name3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESO=C(CCc1ccco1)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H12F3NO2/c15-14(16,17)10-3-1-4-11(9-10)18-13(19)7-6-12-5-2-8-20-12/h1-5,8-9H,6-7H2,(H,18,19)
InChIKeyYDHFKNKXPJUUTL-UHFFFAOYSA-N
XLogP3.87
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.25
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[furan-2-ylmethyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 9333158
N,N'-bis[3-(trifluoromethyl)phenyl]hexanediamide
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3-(furan-2-yl)-N-[3-(hydroxymethyl)phenyl]propanamide
CID 60630108
(2S)-2-(furan-2-ylmethylamino)-4-oxo-4-[3-(trifluoromethyl)anilino]butanoic acid
CID 1297837
N-[3-(furan-2-yl)propyl]-3-(trifluoromethyl)aniline
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3-[3-oxo-3-[3-(trifluoromethyl)anilino]propyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 3619896
N-(furan-2-ylmethyl)-3-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 54833538
CID 89006052
CID 89006052
3-[3-(2-aminophenyl)propanoylamino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 54795446
4-(furan-2-ylmethyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 6464316
N-[3-(trifluoromethyl)phenyl]hexanamide
CID 4609508
6-oxo-N-[3-(trifluoromethyl)phenyl]heptanamide
CID 12857135

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (CID 8762528) is 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is O=C(CCc1ccco1)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is YDHFKNKXPJUUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO2/c15-14(16,17)10-3-1-4-11(9-10)18-13(19)7-6-12-5-2-8-20-12/h1-5,8-9H,6-7H2,(H,18,19).
What are the key properties of 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 283.25 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 8762528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).