N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide

C15H14F3NO3 — CID 17398504

IUPACN-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccoc1
InChIInChI=1S/C15H14F3NO3/c1-2-6-22-13-4-3-11(15(16,17)18)8-12(13)19-14(20)10-5-7-21-9-10/h3-5,7-9H,2,6H2,1H3,(H,19,20)
InChIKeyGPEKLHXLNZZOMR-UHFFFAOYSA-N
MW313.28 g/mol
LogP4.34
Rot. Bonds5

About N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide

N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide (PubChem CID 17398504) has the molecular formula C15H14F3NO3 and a molecular weight of 313.28 g/mol. Its IUPAC name is N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide
PubChem CID17398504
Molecular FormulaC15H14F3NO3
Molecular Weight313.28 g/mol
Exact Mass313.09
IUPAC NameN-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide
SMILESCCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccoc1
InChIInChI=1S/C15H14F3NO3/c1-2-6-22-13-4-3-11(15(16,17)18)8-12(13)19-14(20)10-5-7-21-9-10/h3-5,7-9H,2,6H2,1H3,(H,19,20)
InChIKeyGPEKLHXLNZZOMR-UHFFFAOYSA-N
XLogP4.34
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.28
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzamide
CID 26175480
2-methylsulfanyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 112765166
2-chloro-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 4656638
5-acetyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 36667250
3,3-dimethyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]butanamide
CID 112765185
4-(2-methoxyethylsulfamoyl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzamide
CID 55524220
N-[5-chloro-2-(2,2,2-trifluoroethoxy)phenyl]furan-3-carboxamide
CID 37175499
4-fluoro-2-iodo-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzamide
CID 38905531
1-butyl-6-oxo-N-[2-propoxy-5-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 31483011
3-morpholin-4-ylsulfonyl-N-[2-propoxy-5-(trifluoromethyl)phenyl]benzamide
CID 26175483
3,5-dimethoxy-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]benzamide
CID 2671998
1-oxo-N-[2-propoxy-5-(trifluoromethyl)phenyl]-2H-isoquinoline-3-carboxamide
CID 39948602

Frequently Asked Questions

What is the IUPAC name of N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide?
The IUPAC name of N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide (CID 17398504) is N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide?
The canonical SMILES for N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide is CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccoc1.
What is the InChIKey of N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide?
The InChIKey is GPEKLHXLNZZOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3NO3/c1-2-6-22-13-4-3-11(15(16,17)18)8-12(13)19-14(20)10-5-7-21-9-10/h3-5,7-9H,2,6H2,1H3,(H,19,20).
What are the key properties of N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide?
N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide has a molecular weight of 313.28 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-propoxy-5-(trifluoromethyl)phenyl]furan-3-carboxamide is sourced from PubChem (CID 17398504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).