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

C19H14F3NO2 — CID 16650690

IUPAC2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C19H14F3NO2/c1-12-14(11-17(25-12)13-7-3-2-4-8-13)18(24)23-16-10-6-5-9-15(16)19(20,21)22/h2-11H,1H3,(H,23,24)
InChIKeyBRYNWJOURLAFRY-UHFFFAOYSA-N
MW345.32 g/mol
LogP5.53
Rot. Bonds3

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

2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide (PubChem CID 16650690) has the molecular formula C19H14F3NO2 and a molecular weight of 345.32 g/mol. Its IUPAC name is 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide
PubChem CID16650690
Molecular FormulaC19H14F3NO2
Molecular Weight345.32 g/mol
Exact Mass345.10
IUPAC Name2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C19H14F3NO2/c1-12-14(11-17(25-12)13-7-3-2-4-8-13)18(24)23-16-10-6-5-9-15(16)19(20,21)22/h2-11H,1H3,(H,23,24)
InChIKeyBRYNWJOURLAFRY-UHFFFAOYSA-N
XLogP5.53
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.32
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 2742876
N-(4-iodophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 1340506
N-(4-acetylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 16650627
5-methyl-3-phenyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
CID 1223086
N-(4-carbamoylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 17015561
4-methyl-2-phenyl-N-[2-(trifluoromethyl)phenyl]pyrimidine-5-carboxamide
CID 53080350
2-amino-5-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
CID 62511382
N-(2-ethoxyphenyl)-2-methyl-5-(4-methylphenyl)furan-3-carboxamide
CID 16650745
methyl 2-[[2-(trifluoromethyl)phenyl]carbamoyl]benzoate
CID 108785392
2,4-dimethyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazole-5-carboxamide
CID 110684897
2-bromo-3-methyl-N-[2-(trifluoromethyl)phenyl]benzamide
CID 103857081
2-methyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-5-phenylfuran-3-carboxamide
CID 11530819

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide (CID 16650690) is 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide is Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide?
The InChIKey is BRYNWJOURLAFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO2/c1-12-14(11-17(25-12)13-7-3-2-4-8-13)18(24)23-16-10-6-5-9-15(16)19(20,21)22/h2-11H,1H3,(H,23,24).
What are the key properties of 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide?
2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide has a molecular weight of 345.32 g/mol, XLogP of 5.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide is sourced from PubChem (CID 16650690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).