2-amino-N-(4-bromophenyl)acetamide

C8H9BrN2O — CID 871334

IUPAC2-amino-N-(4-bromophenyl)acetamide
SMILESNCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C8H9BrN2O/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5,10H2,(H,11,12)
InChIKeyAXRMYSHRBDXGGO-UHFFFAOYSA-N
MW229.08 g/mol
LogP1.35
Rot. Bonds2

About 2-amino-N-(4-bromophenyl)acetamide

2-amino-N-(4-bromophenyl)acetamide (PubChem CID 871334) has the molecular formula C8H9BrN2O and a molecular weight of 229.08 g/mol. Its IUPAC name is 2-amino-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(4-bromophenyl)acetamide
PubChem CID871334
Molecular FormulaC8H9BrN2O
Molecular Weight229.08 g/mol
Exact Mass227.99
IUPAC Name2-amino-N-(4-bromophenyl)acetamide
SMILESNCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C8H9BrN2O/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5,10H2,(H,11,12)
InChIKeyAXRMYSHRBDXGGO-UHFFFAOYSA-N
XLogP1.35
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.08
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-amino-N-(4-bromophenyl)acetamide (CID 871334) is 2-amino-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-amino-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-amino-N-(4-bromophenyl)acetamide is NCC(=O)Nc1ccc(Br)cc1.
What is the InChIKey of 2-amino-N-(4-bromophenyl)acetamide?
The InChIKey is AXRMYSHRBDXGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrN2O/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5,10H2,(H,11,12).
What are the key properties of 2-amino-N-(4-bromophenyl)acetamide?
2-amino-N-(4-bromophenyl)acetamide has a molecular weight of 229.08 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 871334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).