(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide

C18H18BrNO3 — CID 8958059

IUPAC(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(C)cc1Br
InChIInChI=1S/C18H18BrNO3/c1-11-8-9-17(15(19)10-11)23-13(3)18(22)20-16-7-5-4-6-14(16)12(2)21/h4-10,13H,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyKFPZUKFFASLVPM-CYBMUJFWSA-N
MW376.25 g/mol
LogP4.37
Rot. Bonds5

About (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide

(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide (PubChem CID 8958059) has the molecular formula C18H18BrNO3 and a molecular weight of 376.25 g/mol. Its IUPAC name is (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide
PubChem CID8958059
Molecular FormulaC18H18BrNO3
Molecular Weight376.25 g/mol
Exact Mass375.05
IUPAC Name(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide
SMILESCC(=O)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(C)cc1Br
InChIInChI=1S/C18H18BrNO3/c1-11-8-9-17(15(19)10-11)23-13(3)18(22)20-16-7-5-4-6-14(16)12(2)21/h4-10,13H,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyKFPZUKFFASLVPM-CYBMUJFWSA-N
XLogP4.37
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.25
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide 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-bromo-4-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 46633932
2-(2-bromo-4-methylphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 46633931
2-(2-bromo-4-methylphenoxy)-N-(2-ethylsulfonylphenyl)propanamide
CID 55778334
(2S)-N-(2-acetylphenyl)-2-(4-bromo-2-fluorophenoxy)propanamide
CID 8730300
(2R)-N-(2-bromophenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 837584
N'-[2-(2-bromo-4-methylphenoxy)propanoyl]-2-chlorobenzohydrazide
CID 55771819
(2R)-2-(2-bromo-4-methylphenoxy)-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 51958225
2-[[(2R)-2-(2-bromo-4-chlorophenoxy)propanoyl]amino]benzamide
CID 40771324
2-(2-bromo-4-methylphenoxy)-N-(2,6-difluorophenyl)propanamide
CID 51236277
2-(2-bromo-4-methylphenoxy)-N-(5-chloro-2-hydroxyphenyl)propanamide
CID 56581617
2-(2-bromo-4-methylphenoxy)propanehydrazide
CID 2789718
[1-(2-acetylanilino)-1-oxopropan-2-yl] 2-(4-methylphenoxy)propanoate
CID 16567139

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide (CID 8958059) is (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide is CC(=O)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(C)cc1Br.
What is the InChIKey of (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide?
The InChIKey is KFPZUKFFASLVPM-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H18BrNO3/c1-11-8-9-17(15(19)10-11)23-13(3)18(22)20-16-7-5-4-6-14(16)12(2)21/h4-10,13H,1-3H3,(H,20,22)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide?
(2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide has a molecular weight of 376.25 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-acetylphenyl)-2-(2-bromo-4-methylphenoxy)propanamide is sourced from PubChem (CID 8958059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).