2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide

C16H16BrNO2 — CID 112777983

IUPAC2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)Oc2ccccc2Br)cc1
InChIInChI=1S/C16H16BrNO2/c1-11-7-9-13(10-8-11)18-16(19)12(2)20-15-6-4-3-5-14(15)17/h3-10,12H,1-2H3,(H,18,19)
InChIKeySOLJQDXDRVIQLP-UHFFFAOYSA-N
MW334.21 g/mol
LogP4.16
Rot. Bonds4

About 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide

2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide (PubChem CID 112777983) has the molecular formula C16H16BrNO2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide
PubChem CID112777983
Molecular FormulaC16H16BrNO2
Molecular Weight334.21 g/mol
Exact Mass333.04
IUPAC Name2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)Oc2ccccc2Br)cc1
InChIInChI=1S/C16H16BrNO2/c1-11-7-9-13(10-8-11)18-16(19)12(2)20-15-6-4-3-5-14(15)17/h3-10,12H,1-2H3,(H,18,19)
InChIKeySOLJQDXDRVIQLP-UHFFFAOYSA-N
XLogP4.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-bromophenoxy)-N-(4-methylphenyl)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)-2-(2-bromophenoxy)-N-phenylpropanamide
CID 7394881
4-[2-(2-bromophenoxy)propanoylamino]benzamide
CID 84603766
2-(2-bromophenoxy)-N-[4-(difluoromethoxy)phenyl]propanamide
CID 84603771
2-(2-ethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53284965
(2R)-2-(2-cyanophenoxy)-N-(4-methylphenyl)propanamide
CID 2565309
2-(2-bromophenoxy)-N-(3-hydroxyphenyl)propanamide
CID 6472883
(2R)-2-(2-bromophenoxy)-N-(3-hydroxyphenyl)propanamide
CID 40639361
N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701
(2R)-N-(4-methylphenyl)-2-(2-nitrophenoxy)propanamide
CID 7503574
N-(4-aminophenyl)-2-(2-bromo-4-methylphenoxy)propanamide
CID 43200099
[1-(4-methylanilino)-1-oxopropan-2-yl] 2-bromobenzoate
CID 4613859
3-[2-(2-bromophenoxy)propanoylamino]benzoic acid
CID 17341904

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide?
The IUPAC name of 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide (CID 112777983) is 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide is Cc1ccc(NC(=O)C(C)Oc2ccccc2Br)cc1.
What is the InChIKey of 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide?
The InChIKey is SOLJQDXDRVIQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO2/c1-11-7-9-13(10-8-11)18-16(19)12(2)20-15-6-4-3-5-14(15)17/h3-10,12H,1-2H3,(H,18,19).
What are the key properties of 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide?
2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide has a molecular weight of 334.21 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 112777983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).