N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide

C16H14F3NO — CID 2684380

IUPACN-(4-ethylphenyl)-3-(trifluoromethyl)benzamide
SMILESCCc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C16H14F3NO/c1-2-11-6-8-14(9-7-11)20-15(21)12-4-3-5-13(10-12)16(17,18)19/h3-10H,2H2,1H3,(H,20,21)
InChIKeyCPQBWVMWWVNHLM-UHFFFAOYSA-N
MW293.29 g/mol
LogP4.52
Rot. Bonds3

About N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide

N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide (PubChem CID 2684380) has the molecular formula C16H14F3NO and a molecular weight of 293.29 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3-(trifluoromethyl)benzamide
PubChem CID2684380
Molecular FormulaC16H14F3NO
Molecular Weight293.29 g/mol
Exact Mass293.10
IUPAC NameN-(4-ethylphenyl)-3-(trifluoromethyl)benzamide
SMILESCCc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1
InChIInChI=1S/C16H14F3NO/c1-2-11-6-8-14(9-7-11)20-15(21)12-4-3-5-13(10-12)16(17,18)19/h3-10H,2H2,1H3,(H,20,21)
InChIKeyCPQBWVMWWVNHLM-UHFFFAOYSA-N
XLogP4.52
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N'-(4-ethylbenzoyl)-3-(trifluoromethyl)benzohydrazide
CID 7925712
1-(4-ethylphenyl)-3-[3-(trifluoromethyl)phenyl]propane-1,3-dione
CID 22947144
3-N-tert-butyl-1-N-(4-ethylphenyl)benzene-1,3-dicarboxamide
CID 109056003
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-3-(trifluoromethyl)benzamide
CID 51566572
N-(4-ethynylphenyl)-3-(trifluoromethyl)benzamide
CID 3751377
N-(4-ethylphenyl)benzamide
CID 774063
3-[(4-acetamidobenzoyl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 46513546
N-[4-(cyclopropanecarbonylamino)phenyl]-3-(trifluoromethyl)benzamide
CID 25275995
N-[3-(diethylcarbamoyl)phenyl]-3-(trifluoromethyl)benzamide
CID 17435315
3-N-(4-ethylphenyl)-1-N-propylbenzene-1,3-dicarboxamide
CID 109050379
1-(4-ethylphenyl)-3-[3-(trifluoromethyl)phenyl]propane-1,3-dione;1-(4-hydroxyphenyl)-3-[3-(trifluoromethyl)phenyl]propane-1,3-dione
CID 91590027
4-chloro-N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide
CID 143174015

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide?
The IUPAC name of N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide (CID 2684380) is N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide is CCc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide?
The InChIKey is CPQBWVMWWVNHLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO/c1-2-11-6-8-14(9-7-11)20-15(21)12-4-3-5-13(10-12)16(17,18)19/h3-10H,2H2,1H3,(H,20,21).
What are the key properties of N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide?
N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide has a molecular weight of 293.29 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 2684380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).