2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide

C16H14BrFN2O2 — CID 49165568

IUPAC2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H14BrFN2O2/c17-12-3-1-11(2-4-12)9-15(21)19-10-16(22)20-14-7-5-13(18)6-8-14/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyRVEWBYHGBKXCNG-UHFFFAOYSA-N
MW365.20 g/mol
LogP2.89
Rot. Bonds5

About 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide

2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide (PubChem CID 49165568) has the molecular formula C16H14BrFN2O2 and a molecular weight of 365.20 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
PubChem CID49165568
Molecular FormulaC16H14BrFN2O2
Molecular Weight365.20 g/mol
Exact Mass364.02
IUPAC Name2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
SMILESO=C(Cc1ccc(Br)cc1)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H14BrFN2O2/c17-12-3-1-11(2-4-12)9-15(21)19-10-16(22)20-14-7-5-13(18)6-8-14/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChIKeyRVEWBYHGBKXCNG-UHFFFAOYSA-N
XLogP2.89
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.20
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
CID 112996188
2-(4-bromophenyl)-N-[2-(4-ethylanilino)-2-oxoethyl]acetamide
CID 112996813
2-[(4-bromophenyl)carbamoylamino]-N-(4-fluorophenyl)acetamide
CID 60605382
N-[2-(3-bromo-4-methylanilino)-2-oxoethyl]-2-(4-fluorophenyl)acetamide
CID 112998503
methyl 4-[[2-[[2-(4-fluorophenyl)acetyl]amino]acetyl]amino]benzoate
CID 112999943
[2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-2-oxoethyl] 4-bromobenzoate
CID 2625840
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
methyl 2-[[2-[4-[[2-[(4-fluorophenyl)methylcarbamoylamino]acetyl]amino]phenyl]acetyl]amino]acetate
CID 55964096
4-bromo-N-[(4-fluorophenyl)methyl]-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 4044086
N-[2-(4-ethylanilino)-2-oxoethyl]-4-fluorobenzamide
CID 26697243
N-(4-bromophenyl)-3-[(4-fluorophenyl)methylamino]propanamide
CID 109021254
2-[(4-bromophenyl)methyl-methylamino]-N-(4-fluorophenyl)acetamide
CID 9253204

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide (CID 49165568) is 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide is O=C(Cc1ccc(Br)cc1)NCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
The InChIKey is RVEWBYHGBKXCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrFN2O2/c17-12-3-1-11(2-4-12)9-15(21)19-10-16(22)20-14-7-5-13(18)6-8-14/h1-8H,9-10H2,(H,19,21)(H,20,22).
What are the key properties of 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide?
2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide has a molecular weight of 365.20 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 49165568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).