2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide

C19H16BrNO2 — CID 1328520

IUPAC2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide
SMILESCc1cc(Br)ccc1OCC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-18(13)23-12-19(22)21-17-8-4-6-14-5-2-3-7-16(14)17/h2-11H,12H2,1H3,(H,21,22)
InChIKeyNBEXDDBZBOVOFN-UHFFFAOYSA-N
MW370.25 g/mol
LogP4.93
Rot. Bonds4

About 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide

2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide (PubChem CID 1328520) has the molecular formula C19H16BrNO2 and a molecular weight of 370.25 g/mol. Its IUPAC name is 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide
PubChem CID1328520
Molecular FormulaC19H16BrNO2
Molecular Weight370.25 g/mol
Exact Mass369.04
IUPAC Name2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide
SMILESCc1cc(Br)ccc1OCC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-18(13)23-12-19(22)21-17-8-4-6-14-5-2-3-7-16(14)17/h2-11H,12H2,1H3,(H,21,22)
InChIKeyNBEXDDBZBOVOFN-UHFFFAOYSA-N
XLogP4.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.25
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide 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

N-(2-acetamidophenyl)-2-(4-bromo-2-methylphenoxy)acetamide
CID 1328492
N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide
CID 1325558
2-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-N-methylbenzamide
CID 17354006
2-(2,3-dimethylphenoxy)-N-naphthalen-1-ylacetamide
CID 720683
2-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-N-ethylbenzamide
CID 4949446
4-[2-[2-(4-bromo-2-methylphenoxy)acetyl]hydrazinyl]-N-(2-chlorophenyl)-4-oxobutanamide
CID 5176598
2-(4-bromo-2-methylphenoxy)-N-[4-[4-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-3-methylphenyl]-2-methylphenyl]acetamide
CID 5180819
2-(2-methoxy-4-methylphenoxy)-N-naphthalen-1-ylacetamide
CID 2627702
N-[[[2-(4-bromo-2-methylphenoxy)acetyl]amino]carbamothioyl]-2-naphthalen-1-yloxyacetamide
CID 4513457
2-(1-bromonaphthalen-2-yl)oxy-N-(2,3-dimethylphenyl)acetamide
CID 1299627
2-(4-bromo-2-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 695854
N-(4-anilinophenyl)-2-(4-bromo-2-methylphenoxy)acetamide
CID 1013861

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide (CID 1328520) is 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide is Cc1cc(Br)ccc1OCC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide?
The InChIKey is NBEXDDBZBOVOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-18(13)23-12-19(22)21-17-8-4-6-14-5-2-3-7-16(14)17/h2-11H,12H2,1H3,(H,21,22).
What are the key properties of 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide?
2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide has a molecular weight of 370.25 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 1328520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).