2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide

C16H17BrN2O3 — CID 87030481

IUPAC2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(Br)cc1NCC(=O)Nc1ccccc1OC
InChIInChI=1S/C16H17BrN2O3/c1-21-14-6-4-3-5-12(14)19-16(20)10-18-13-9-11(17)7-8-15(13)22-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyGJKDSGBFLKUCSR-UHFFFAOYSA-N
MW365.23 g/mol
LogP3.52
Rot. Bonds6

About 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide

2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide (PubChem CID 87030481) has the molecular formula C16H17BrN2O3 and a molecular weight of 365.23 g/mol. Its IUPAC name is 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide
PubChem CID87030481
Molecular FormulaC16H17BrN2O3
Molecular Weight365.23 g/mol
Exact Mass364.04
IUPAC Name2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(Br)cc1NCC(=O)Nc1ccccc1OC
InChIInChI=1S/C16H17BrN2O3/c1-21-14-6-4-3-5-12(14)19-16(20)10-18-13-9-11(17)7-8-15(13)22-2/h3-9,18H,10H2,1-2H3,(H,19,20)
InChIKeyGJKDSGBFLKUCSR-UHFFFAOYSA-N
XLogP3.52
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.23
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-bromo-2-methoxyanilino)-N-(3-fluorophenyl)acetamide
CID 61061796
N-(5-bromo-2-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 55905124
2-(2,5-dimethylanilino)-N-(2-methoxyphenyl)acetamide
CID 9079653
2-(4-bromo-3-methylanilino)-N-(2-methoxyphenyl)acetamide
CID 9099476
N-(2-methoxyphenyl)-2-(2-phenoxyanilino)acetamide
CID 7922855
2-(2-methoxyanilino)-N-phenylacetamide
CID 7636827
2-[[2-(2-methoxyanilino)acetyl]amino]benzoic acid
CID 18929239
2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 33169745
5-bromo-2-[2-(2-methoxyanilino)-2-oxoethoxy]benzoate
CID 2164227
N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
CID 2456629
2-(2,5-dimethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54814166
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide (CID 87030481) is 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide is COc1ccc(Br)cc1NCC(=O)Nc1ccccc1OC.
What is the InChIKey of 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide?
The InChIKey is GJKDSGBFLKUCSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN2O3/c1-21-14-6-4-3-5-12(14)19-16(20)10-18-13-9-11(17)7-8-15(13)22-2/h3-9,18H,10H2,1-2H3,(H,19,20).
What are the key properties of 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide?
2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide has a molecular weight of 365.23 g/mol, XLogP of 3.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 87030481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).