2-(2-bromophenoxy)-N-methylacetamide

C9H10BrNO2 — CID 8024487

IUPAC2-(2-bromophenoxy)-N-methylacetamide
SMILESCNC(=O)COc1ccccc1Br
InChIInChI=1S/C9H10BrNO2/c1-11-9(12)6-13-8-5-3-2-4-7(8)10/h2-5H,6H2,1H3,(H,11,12)
InChIKeyHIEWPLFPHYPXIB-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.57
Rot. Bonds3

About 2-(2-bromophenoxy)-N-methylacetamide

2-(2-bromophenoxy)-N-methylacetamide (PubChem CID 8024487) has the molecular formula C9H10BrNO2 and a molecular weight of 244.09 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-methylacetamide
PubChem CID8024487
Molecular FormulaC9H10BrNO2
Molecular Weight244.09 g/mol
Exact Mass242.99
IUPAC Name2-(2-bromophenoxy)-N-methylacetamide
SMILESCNC(=O)COc1ccccc1Br
InChIInChI=1S/C9H10BrNO2/c1-11-9(12)6-13-8-5-3-2-4-7(8)10/h2-5H,6H2,1H3,(H,11,12)
InChIKeyHIEWPLFPHYPXIB-UHFFFAOYSA-N
XLogP1.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-bromophenoxy)-N-methylacetamide 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

2-[[2-(2-bromophenoxy)acetyl]amino]acetic acid
CID 19176585
2-(2-bromophenoxy)-N-butylacetamide
CID 55029150
2-(2-bromophenoxy)-N-butan-2-ylacetamide
CID 19170000
3-[[2-(2-bromophenoxy)acetyl]amino]butanoic acid
CID 120522773
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
N-methyl-2-[2-(methylaminomethyl)phenoxy]acetamide
CID 43277188
2-(2-benzylphenoxy)-N-methylacetamide
CID 7661700
2-[4-(aminomethyl)-2-bromophenoxy]-N-methylacetamide
CID 63046001
2-[2-bromo-4-(methylaminomethyl)phenoxy]-N-methylacetamide
CID 63044978
2-(2-bromophenoxy)-N-(4-ethoxyphenyl)acetamide
CID 1183062
2-(2-bromophenoxy)-N-(2-tert-butylphenyl)acetamide
CID 31277256
2-(2-bromophenoxy)-N-(4-phenylbutan-2-yl)acetamide
CID 4781197

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-methylacetamide?
The IUPAC name of 2-(2-bromophenoxy)-N-methylacetamide (CID 8024487) is 2-(2-bromophenoxy)-N-methylacetamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-methylacetamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-methylacetamide is CNC(=O)COc1ccccc1Br.
What is the InChIKey of 2-(2-bromophenoxy)-N-methylacetamide?
The InChIKey is HIEWPLFPHYPXIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNO2/c1-11-9(12)6-13-8-5-3-2-4-7(8)10/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of 2-(2-bromophenoxy)-N-methylacetamide?
2-(2-bromophenoxy)-N-methylacetamide has a molecular weight of 244.09 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-methylacetamide is sourced from PubChem (CID 8024487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).