(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide

C17H18BrNO2 — CID 9172923

IUPAC(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(Br)c(C)c2)cc1
InChIInChI=1S/C17H18BrNO2/c1-11-4-7-15(8-5-11)21-13(3)17(20)19-14-6-9-16(18)12(2)10-14/h4-10,13H,1-3H3,(H,19,20)/t13-/m1/s1
InChIKeyHALSDXRKFZPKOV-CYBMUJFWSA-N
MW348.24 g/mol
LogP4.47
Rot. Bonds4

About (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide

(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide (PubChem CID 9172923) has the molecular formula C17H18BrNO2 and a molecular weight of 348.24 g/mol. Its IUPAC name is (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide
PubChem CID9172923
Molecular FormulaC17H18BrNO2
Molecular Weight348.24 g/mol
Exact Mass347.05
IUPAC Name(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(Br)c(C)c2)cc1
InChIInChI=1S/C17H18BrNO2/c1-11-4-7-15(8-5-11)21-13(3)17(20)19-14-6-9-16(18)12(2)10-14/h4-10,13H,1-3H3,(H,19,20)/t13-/m1/s1
InChIKeyHALSDXRKFZPKOV-CYBMUJFWSA-N
XLogP4.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.24
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-N-(4-bromo-3-methylphenyl)-2-(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

(2S)-N-(4-bromo-3-methylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 9173242
N-(3,5-dimethylphenyl)-2-(4-methylphenoxy)propanamide
CID 4928504
(2R)-N-(4-bromo-3-methylphenyl)-2-(3-chlorophenoxy)propanamide
CID 92647263
(2S)-N-(4-bromo-3-methylphenyl)-2-(3-chlorophenoxy)propanamide
CID 92647264
(2R)-N-(3-bromophenyl)-2-(4-methylphenoxy)propanamide
CID 26157123
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53266277
N-(4-bromo-3-methylphenyl)-2-(2-methylphenoxy)propanamide
CID 43876544
(2R)-2-(4-methylphenoxy)-N-naphthalen-2-ylpropanamide
CID 837371
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701
N-(4-bromo-3-methylphenyl)-2-hydroxypropanamide
CID 82132450
2-bromo-N-(4-bromo-3-methylphenyl)propanamide
CID 12708491

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide (CID 9172923) is (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide is Cc1ccc(O[C@H](C)C(=O)Nc2ccc(Br)c(C)c2)cc1.
What is the InChIKey of (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide?
The InChIKey is HALSDXRKFZPKOV-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H18BrNO2/c1-11-4-7-15(8-5-11)21-13(3)17(20)19-14-6-9-16(18)12(2)10-14/h4-10,13H,1-3H3,(H,19,20)/t13-/m1/s1.
What are the key properties of (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide?
(2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide has a molecular weight of 348.24 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-bromo-3-methylphenyl)-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 9172923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).