N-(4-bromophenyl)-2-methoxyacetamide

C9H10BrNO2 — CID 532084

IUPACN-(4-bromophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C9H10BrNO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyUWPRWZGIASZACV-UHFFFAOYSA-N
MW244.09 g/mol
LogP2.03
Rot. Bonds3

About N-(4-bromophenyl)-2-methoxyacetamide

N-(4-bromophenyl)-2-methoxyacetamide (PubChem CID 532084) has the molecular formula C9H10BrNO2 and a molecular weight of 244.09 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-methoxyacetamide
PubChem CID532084
Molecular FormulaC9H10BrNO2
Molecular Weight244.09 g/mol
Exact Mass242.99
IUPAC NameN-(4-bromophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C9H10BrNO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyUWPRWZGIASZACV-UHFFFAOYSA-N
XLogP2.03
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 ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-methoxyacetamide?
The IUPAC name of N-(4-bromophenyl)-2-methoxyacetamide (CID 532084) is N-(4-bromophenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-methoxyacetamide?
The canonical SMILES for N-(4-bromophenyl)-2-methoxyacetamide is COCC(=O)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-methoxyacetamide?
The InChIKey is UWPRWZGIASZACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of N-(4-bromophenyl)-2-methoxyacetamide?
N-(4-bromophenyl)-2-methoxyacetamide has a molecular weight of 244.09 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-methoxyacetamide is sourced from PubChem (CID 532084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).