2-(4-bromophenoxy)-N-carbamoylacetamide

C9H9BrN2O3 — CID 7815609

IUPAC2-(4-bromophenoxy)-N-carbamoylacetamide
SMILESNC(=O)NC(=O)COc1ccc(Br)cc1
InChIInChI=1S/C9H9BrN2O3/c10-6-1-3-7(4-2-6)15-5-8(13)12-9(11)14/h1-4H,5H2,(H3,11,12,13,14)
InChIKeyDZMDZZRSKNAHPM-UHFFFAOYSA-N
MW273.09 g/mol
LogP1.02
Rot. Bonds3

About 2-(4-bromophenoxy)-N-carbamoylacetamide

2-(4-bromophenoxy)-N-carbamoylacetamide (PubChem CID 7815609) has the molecular formula C9H9BrN2O3 and a molecular weight of 273.09 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-carbamoylacetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-carbamoylacetamide
PubChem CID7815609
Molecular FormulaC9H9BrN2O3
Molecular Weight273.09 g/mol
Exact Mass271.98
IUPAC Name2-(4-bromophenoxy)-N-carbamoylacetamide
SMILESNC(=O)NC(=O)COc1ccc(Br)cc1
InChIInChI=1S/C9H9BrN2O3/c10-6-1-3-7(4-2-6)15-5-8(13)12-9(11)14/h1-4H,5H2,(H3,11,12,13,14)
InChIKeyDZMDZZRSKNAHPM-UHFFFAOYSA-N
XLogP1.02
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.09
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-bromophenoxy)-N-carbamoylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]acetamide
CID 1728318
1-[2-(4-Bromophenoxy)acetyl]imidazolidin-2-one
CID 5299798
1-[2-(2-Bromophenoxy)acetyl]imidazolidin-2-one
CID 9466285
N-(tert-butylcarbamoyl)-2-(2,4-dibromophenoxy)acetamide
CID 2632575
2-(2,4-dibromophenoxy)-N-[oxo-(propan-2-ylamino)methyl]acetamide
CID 2632577
N-(cyclopentylcarbamoyl)-2-(2,4-dibromophenoxy)acetamide
CID 2632678
2-(2-bromophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 7847650
2-(2,4-dibromophenoxy)-N-(ethylcarbamoyl)propanamide
CID 16196796
2-(4-bromophenoxy)-N,N-dimethylacetamide
CID 879442
2-(4-bromophenoxy)-N-cyclopropylacetamide
CID 2631886
2-(4-bromophenoxy)-N-hydroxyacetamide
CID 3598816
N-[2-(4-bromophenoxy)ethyl]acetamide
CID 16762877

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-carbamoylacetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-carbamoylacetamide (CID 7815609) is 2-(4-bromophenoxy)-N-carbamoylacetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-carbamoylacetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-carbamoylacetamide is NC(=O)NC(=O)COc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenoxy)-N-carbamoylacetamide?
The InChIKey is DZMDZZRSKNAHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN2O3/c10-6-1-3-7(4-2-6)15-5-8(13)12-9(11)14/h1-4H,5H2,(H3,11,12,13,14).
What are the key properties of 2-(4-bromophenoxy)-N-carbamoylacetamide?
2-(4-bromophenoxy)-N-carbamoylacetamide has a molecular weight of 273.09 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-carbamoylacetamide is sourced from PubChem (CID 7815609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).