2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide

C10H13BrN2O2 — CID 82502070

IUPAC2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccc(Br)cc1N(C)C(=O)CN
InChIInChI=1S/C10H13BrN2O2/c1-13(10(14)6-12)8-5-7(11)3-4-9(8)15-2/h3-5H,6,12H2,1-2H3
InChIKeyPWCBXOODWYWPMH-UHFFFAOYSA-N
MW273.13 g/mol
LogP1.38
Rot. Bonds3

About 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide

2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide (PubChem CID 82502070) has the molecular formula C10H13BrN2O2 and a molecular weight of 273.13 g/mol. Its IUPAC name is 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide
PubChem CID82502070
Molecular FormulaC10H13BrN2O2
Molecular Weight273.13 g/mol
Exact Mass272.02
IUPAC Name2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccc(Br)cc1N(C)C(=O)CN
InChIInChI=1S/C10H13BrN2O2/c1-13(10(14)6-12)8-5-7(11)3-4-9(8)15-2/h3-5H,6,12H2,1-2H3
InChIKeyPWCBXOODWYWPMH-UHFFFAOYSA-N
XLogP1.38
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.13
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-methoxyphenyl)-3-chloro-N-methylpropanamide
CID 115162399
N-(5-bromo-2-methoxyphenyl)-N-methyl-3-sulfanylpropanamide
CID 115167730
N-(5-bromo-2-methoxyphenyl)-N-methylcarbamoyl bromide
CID 115193399
3-amino-N-(5-bromo-2-methoxyphenyl)-N,2-dimethylpropanamide
CID 115153548
1-(aminomethyl)-N-(5-bromo-2-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
CID 115182600
2-amino-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide
CID 60938044
2-amino-N-(5-bromo-2-methoxyphenyl)-3-hydroxy-N-methylpropanamide
CID 115179710
N-(5-bromo-2-methoxyphenyl)-N-methyl-2-oxoacetamide
CID 115166038
1-(aminomethyl)-N-(5-bromo-2-methoxyphenyl)-N-methylcyclobutane-1-carboxamide
CID 115183487
2-amino-N-(4-methoxy-2,3-dimethylphenyl)-N-methylacetamide
CID 82494478
N-(5-bromo-2-methoxyphenyl)-2-(hydroxymethyl)-N-methylbutanamide
CID 115186443
3-(5-bromo-2-methoxy-N-methylanilino)-2,2-dimethyl-3-oxopropanoic acid
CID 115163982

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide?
The IUPAC name of 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide (CID 82502070) is 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide is COc1ccc(Br)cc1N(C)C(=O)CN.
What is the InChIKey of 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide?
The InChIKey is PWCBXOODWYWPMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O2/c1-13(10(14)6-12)8-5-7(11)3-4-9(8)15-2/h3-5H,6,12H2,1-2H3.
What are the key properties of 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide?
2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide has a molecular weight of 273.13 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-bromo-2-methoxyphenyl)-N-methylacetamide is sourced from PubChem (CID 82502070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).