2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide

C10H12Br2N2O2 — CID 79473463

IUPAC2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide
SMILESNCCOCC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C10H12Br2N2O2/c11-7-1-2-9(8(12)5-7)14-10(15)6-16-4-3-13/h1-2,5H,3-4,6,13H2,(H,14,15)
InChIKeyAZFJXVMTLAPXJW-UHFFFAOYSA-N
MW352.03 g/mol
LogP2.13
Rot. Bonds5

About 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide

2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide (PubChem CID 79473463) has the molecular formula C10H12Br2N2O2 and a molecular weight of 352.03 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide
PubChem CID79473463
Molecular FormulaC10H12Br2N2O2
Molecular Weight352.03 g/mol
Exact Mass349.93
IUPAC Name2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide
SMILESNCCOCC(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C10H12Br2N2O2/c11-7-1-2-9(8(12)5-7)14-10(15)6-16-4-3-13/h1-2,5H,3-4,6,13H2,(H,14,15)
InChIKeyAZFJXVMTLAPXJW-UHFFFAOYSA-N
XLogP2.13
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.03
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminoethoxy)-N-(2,5-dibromophenyl)acetamide
CID 79474102
butyl N-(2,4-dibromophenyl)carbamate
CID 56698243
3-(2,4-dibromoanilino)-3-oxopropanoic acid
CID 62230789
2-(2-aminoethoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 79463499
2-[2-aminoethyl(methyl)amino]-N-(2,4-dibromophenyl)acetamide
CID 62687733
6-amino-N-(2,4-dibromophenyl)-4,4-dimethylhexanamide
CID 65290987
[2-(2,4-dibromoanilino)-2-oxoethyl] 2-chloro-4,5-difluorobenzoate
CID 2432324
2-(2-aminoethoxy)-N-(2-bromo-4-methyl-5-nitrophenyl)acetamide
CID 104815312
methyl 2-[[2-(2-aminoethoxy)acetyl]amino]-3,5-dibromobenzoate
CID 79473751
N-(4-amino-2-bromophenyl)-2-(2-butoxyethoxy)acetamide
CID 43376800
[2-(2,4-dibromoanilino)-2-oxoethyl] 5,6-dichloropyridine-3-carboxylate
CID 2355123
2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 79464256

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide (CID 79473463) is 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide is NCCOCC(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide?
The InChIKey is AZFJXVMTLAPXJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Br2N2O2/c11-7-1-2-9(8(12)5-7)14-10(15)6-16-4-3-13/h1-2,5H,3-4,6,13H2,(H,14,15).
What are the key properties of 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide?
2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide has a molecular weight of 352.03 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(2,4-dibromophenyl)acetamide is sourced from PubChem (CID 79473463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).