N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

C15H11F3INO — CID 24534873

IUPACN-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(I)cc1
InChIInChI=1S/C15H11F3INO/c16-15(17,18)11-3-1-10(2-4-11)9-14(21)20-13-7-5-12(19)6-8-13/h1-8H,9H2,(H,20,21)
InChIKeyJYYVEEJVZKGEBQ-UHFFFAOYSA-N
MW405.16 g/mol
LogP4.49
Rot. Bonds3

About N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide

N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 24534873) has the molecular formula C15H11F3INO and a molecular weight of 405.16 g/mol. Its IUPAC name is N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID24534873
Molecular FormulaC15H11F3INO
Molecular Weight405.16 g/mol
Exact Mass404.98
IUPAC NameN-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(I)cc1
InChIInChI=1S/C15H11F3INO/c16-15(17,18)11-3-1-10(2-4-11)9-14(21)20-13-7-5-12(19)6-8-13/h1-8H,9H2,(H,20,21)
InChIKeyJYYVEEJVZKGEBQ-UHFFFAOYSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.16
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(4-acetamidophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 51271866
2-(4-hydroxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 14879849
N-(3-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55462625
2-methyl-2-[4-[[2-[4-(trifluoromethyl)phenyl]acetyl]amino]phenyl]propanoic acid
CID 119253975
N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55548784
N-[4-(propan-2-ylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 38197953
N-[4-(difluoromethoxy)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 27147330
2-thiophen-3-yl-N-[4-(trifluoromethyl)phenyl]acetamide
CID 7962160
2-(4-acetamidophenyl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide
CID 9207196
N-(6-amino-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 62901879
N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]-2-phenylacetamide
CID 26686373
2-(1,3-benzodioxol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 110860892

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide (CID 24534873) is N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(I)cc1.
What is the InChIKey of N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is JYYVEEJVZKGEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3INO/c16-15(17,18)11-3-1-10(2-4-11)9-14(21)20-13-7-5-12(19)6-8-13/h1-8H,9H2,(H,20,21).
What are the key properties of N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide?
N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 405.16 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 24534873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).