N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide

C19H19F3N2O2 — CID 4785724

IUPACN-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c1-3-24(4-2)18(26)13-9-11-14(12-10-13)23-17(25)15-7-5-6-8-16(15)19(20,21)22/h5-12H,3-4H2,1-2H3,(H,23,25)
InChIKeyDUQVRUJANXFGIJ-UHFFFAOYSA-N
MW364.37 g/mol
LogP4.44
Rot. Bonds5

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

N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide (PubChem CID 4785724) has the molecular formula C19H19F3N2O2 and a molecular weight of 364.37 g/mol. Its IUPAC name is N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide
PubChem CID4785724
Molecular FormulaC19H19F3N2O2
Molecular Weight364.37 g/mol
Exact Mass364.14
IUPAC NameN-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide
SMILESCCN(CC)C(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c1-3-24(4-2)18(26)13-9-11-14(12-10-13)23-17(25)15-7-5-6-8-16(15)19(20,21)22/h5-12H,3-4H2,1-2H3,(H,23,25)
InChIKeyDUQVRUJANXFGIJ-UHFFFAOYSA-N
XLogP4.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.37
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-4-[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 46686486
N-(4-hydroxyphenyl)-2-(trifluoromethyl)benzamide
CID 28739363
[4-[[2-(trifluoromethyl)benzoyl]amino]phenyl]carbamic acid
CID 18543447
N-[4-(carbamoylamino)phenyl]-2-(trifluoromethyl)benzamide
CID 46530485
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426
N-[4-(2,2,2-trifluoroethoxy)phenyl]-2-(trifluoromethyl)benzamide
CID 134010341
2-chloro-N-[4-(diethylcarbamoyl)phenyl]-4,5-difluorobenzamide
CID 26899774
2-bromo-N-[4-(diethylcarbamoyl)phenyl]-4-fluorobenzamide
CID 9193061
N-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethyl]-2-(trifluoromethyl)benzamide
CID 109468293
N-[3-[ethyl(naphthalen-1-yl)carbamoyl]phenyl]-2-(trifluoromethyl)benzamide
CID 68905948
N-ethyl-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]-2-(trifluoromethyl)benzamide
CID 26356947
N,N-diethyl-N'-naphthalen-2-ylsulfonyl-2-[[4-[[2-(trifluoromethyl)benzoyl]amino]phenyl]methyl]propanediamide
CID 68512971

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide?
The IUPAC name of N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide (CID 4785724) is N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide is CCN(CC)C(=O)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1.
What is the InChIKey of N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide?
The InChIKey is DUQVRUJANXFGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O2/c1-3-24(4-2)18(26)13-9-11-14(12-10-13)23-17(25)15-7-5-6-8-16(15)19(20,21)22/h5-12H,3-4H2,1-2H3,(H,23,25).
What are the key properties of N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide?
N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide has a molecular weight of 364.37 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylcarbamoyl)phenyl]-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 4785724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).