N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide

C17H19BrN2O2 — CID 9099923

IUPACN-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
SMILESCOc1ccc(C)cc1NCC(=O)Nc1ccc(Br)c(C)c1
InChIInChI=1S/C17H19BrN2O2/c1-11-4-7-16(22-3)15(8-11)19-10-17(21)20-13-5-6-14(18)12(2)9-13/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyDAGLNRQDHVIXGE-UHFFFAOYSA-N
MW363.26 g/mol
LogP4.13
Rot. Bonds5

About N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide

N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide (PubChem CID 9099923) has the molecular formula C17H19BrN2O2 and a molecular weight of 363.26 g/mol. Its IUPAC name is N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide.

Molecular Properties

Compound NameN-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
PubChem CID9099923
Molecular FormulaC17H19BrN2O2
Molecular Weight363.26 g/mol
Exact Mass362.06
IUPAC NameN-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
SMILESCOc1ccc(C)cc1NCC(=O)Nc1ccc(Br)c(C)c1
InChIInChI=1S/C17H19BrN2O2/c1-11-4-7-16(22-3)15(8-11)19-10-17(21)20-13-5-6-14(18)12(2)9-13/h4-9,19H,10H2,1-3H3,(H,20,21)
InChIKeyDAGLNRQDHVIXGE-UHFFFAOYSA-N
XLogP4.13
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.26
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-3-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9099482
N-(4-bromo-3-methylphenyl)-2-[5-(dimethylsulfamoyl)-2-methoxyanilino]acetamide
CID 4884058
2-(2-methoxy-5-methylanilino)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 26508692
N-(4-acetylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
CID 26437961
2-(4-bromo-3-methylanilino)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 26508863
N-(4-bromo-3-methylphenyl)-2-(2-chloro-4-methylanilino)acetamide
CID 16553113
2-(4-bromo-3-methylanilino)-N-(2-methoxyphenyl)acetamide
CID 9099476
N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylanilino)acetamide
CID 9081068
N-(4-bromo-3-methylphenyl)-2-(3,4-dimethylanilino)acetamide
CID 109007435
2-(4-bromo-3-methylanilino)-N-(4-methoxyphenyl)acetamide
CID 9099464
N-(2,3-dimethylphenyl)-2-(2-methoxy-5-methylanilino)acetamide
CID 9099909
N-(3,4-dimethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47076752

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide?
The IUPAC name of N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide (CID 9099923) is N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide.
What is the SMILES notation for N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide?
The canonical SMILES for N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide is COc1ccc(C)cc1NCC(=O)Nc1ccc(Br)c(C)c1.
What is the InChIKey of N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide?
The InChIKey is DAGLNRQDHVIXGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrN2O2/c1-11-4-7-16(22-3)15(8-11)19-10-17(21)20-13-5-6-14(18)12(2)9-13/h4-9,19H,10H2,1-3H3,(H,20,21).
What are the key properties of N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide?
N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide has a molecular weight of 363.26 g/mol, XLogP of 4.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methylphenyl)-2-(2-methoxy-5-methylanilino)acetamide is sourced from PubChem (CID 9099923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).