N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide

C15H13BrFNO — CID 4798945

IUPACN-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc(F)cc2)ccc1Br
InChIInChI=1S/C15H13BrFNO/c1-10-8-13(6-7-14(10)16)18-15(19)9-11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,18,19)
InChIKeyULNZIEPFKPMUGD-UHFFFAOYSA-N
MW322.18 g/mol
LogP4.08
Rot. Bonds3

About N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide

N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide (PubChem CID 4798945) has the molecular formula C15H13BrFNO and a molecular weight of 322.18 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide
PubChem CID4798945
Molecular FormulaC15H13BrFNO
Molecular Weight322.18 g/mol
Exact Mass321.02
IUPAC NameN-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc(F)cc2)ccc1Br
InChIInChI=1S/C15H13BrFNO/c1-10-8-13(6-7-14(10)16)18-15(19)9-11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,18,19)
InChIKeyULNZIEPFKPMUGD-UHFFFAOYSA-N
XLogP4.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.18
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N'-(4-bromo-3-methylphenyl)-N-[2-(4-fluorophenyl)ethyl]propanediamide
CID 108948480
N-(4-bromo-3-methylphenyl)-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 113209477
N-[2-(3-bromo-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)acetamide
CID 112998503
N-(4-bromo-3-methylphenyl)-4-(4-fluorophenyl)-4-oxobutanamide
CID 9165178
N-[4-bromo-3-(trifluoromethyl)phenyl]-2-(4-fluorophenyl)acetamide
CID 7920389
N'-(4-bromo-3-methylphenyl)-N-(3-fluorophenyl)propanediamide
CID 108956592
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
N-(4-bromo-3-methylphenyl)-2-thiophen-3-ylacetamide
CID 2486757
2-(4-bromophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 2268328
N-(4-bromo-3-methylphenyl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-4-methyl-6-oxo-1H-pyrimidin-5-yl]acetamide
CID 136616326
[2-(4-bromo-3-methylanilino)-2-oxoethyl] 5-(4-fluoroanilino)-5-oxopentanoate
CID 17261560
N-(2,3-dimethylquinoxalin-6-yl)-2-(4-fluorophenyl)acetamide
CID 110723812

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide (CID 4798945) is N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide is Cc1cc(NC(=O)Cc2ccc(F)cc2)ccc1Br.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is ULNZIEPFKPMUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO/c1-10-8-13(6-7-14(10)16)18-15(19)9-11-2-4-12(17)5-3-11/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide?
N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 322.18 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 4798945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).