2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide

C24H23BrN2O2 — CID 71722765

IUPAC2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C(C(=O)NCc1ccccc1)c1ccccc1Br
InChIInChI=1S/C24H23BrN2O2/c1-18(28)27(17-20-12-6-3-7-13-20)23(21-14-8-9-15-22(21)25)24(29)26-16-19-10-4-2-5-11-19/h2-15,23H,16-17H2,1H3,(H,26,29)
InChIKeyYIDLEBQPHVIVLA-UHFFFAOYSA-N
MW451.36 g/mol
LogP4.86
Rot. Bonds7

About 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide

2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide (PubChem CID 71722765) has the molecular formula C24H23BrN2O2 and a molecular weight of 451.36 g/mol. Its IUPAC name is 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide
PubChem CID71722765
Molecular FormulaC24H23BrN2O2
Molecular Weight451.36 g/mol
Exact Mass450.09
IUPAC Name2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C(C(=O)NCc1ccccc1)c1ccccc1Br
InChIInChI=1S/C24H23BrN2O2/c1-18(28)27(17-20-12-6-3-7-13-20)23(21-14-8-9-15-22(21)25)24(29)26-16-19-10-4-2-5-11-19/h2-15,23H,16-17H2,1H3,(H,26,29)
InChIKeyYIDLEBQPHVIVLA-UHFFFAOYSA-N
XLogP4.86
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.36
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl(benzyl)amino]-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
CID 133214013
2-[acetyl-[(4-chlorophenyl)methyl]amino]-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 133237321
2-[acetyl(benzyl)amino]-N-pentyl-2-phenylacetamide
CID 133237048
N-benzyl-2-[[(1S)-1-(2-bromophenyl)ethyl]amino]acetamide
CID 81378591
2-[acetyl(methyl)amino]-N-benzylpropanamide
CID 10037012
(2S)-N-benzyl-2-[benzyl-(2-thiophen-2-ylacetyl)amino]-2-(2-methylphenyl)acetamide
CID 1434299
N-benzyl-N-[1-(benzylamino)-3-methyl-1-sulfanylidenebutan-2-yl]acetamide
CID 2771455
N-benzyl-2-[benzyl(propanoyl)amino]propanamide
CID 133148772
N-benzyl-N-propan-2-ylacetamide
CID 23534449
2-[acetyl-[(4-fluorophenyl)methyl]amino]-N-[(2-chlorophenyl)methyl]-2-phenylacetamide
CID 133238116
2-[acetyl(benzyl)amino]-N-[2-(4-methoxyphenyl)ethyl]-2-phenylacetamide
CID 133237038
N-benzyl-2-[2-(5-bromo-3-methyl-1,2-dihydroindol-3-yl)ethyl-methylamino]-2-(2-bromophenyl)acetamide
CID 24955107

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide?
The IUPAC name of 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide (CID 71722765) is 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide.
What is the SMILES notation for 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide?
The canonical SMILES for 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide is CC(=O)N(Cc1ccccc1)C(C(=O)NCc1ccccc1)c1ccccc1Br.
What is the InChIKey of 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide?
The InChIKey is YIDLEBQPHVIVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23BrN2O2/c1-18(28)27(17-20-12-6-3-7-13-20)23(21-14-8-9-15-22(21)25)24(29)26-16-19-10-4-2-5-11-19/h2-15,23H,16-17H2,1H3,(H,26,29).
What are the key properties of 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide?
2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide has a molecular weight of 451.36 g/mol, XLogP of 4.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(benzyl)amino]-N-benzyl-2-(2-bromophenyl)acetamide is sourced from PubChem (CID 71722765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).