2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide

C10H13BrN2O — CID 107574130

IUPAC2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide
SMILESCc1cc(NC(=O)CN)cc(C)c1Br
InChIInChI=1S/C10H13BrN2O/c1-6-3-8(13-9(14)5-12)4-7(2)10(6)11/h3-4H,5,12H2,1-2H3,(H,13,14)
InChIKeyHQVRIVBFPMUXQV-UHFFFAOYSA-N
MW257.13 g/mol
LogP1.96
Rot. Bonds2

About 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide

2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide (PubChem CID 107574130) has the molecular formula C10H13BrN2O and a molecular weight of 257.13 g/mol. Its IUPAC name is 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide
PubChem CID107574130
Molecular FormulaC10H13BrN2O
Molecular Weight257.13 g/mol
Exact Mass256.02
IUPAC Name2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide
SMILESCc1cc(NC(=O)CN)cc(C)c1Br
InChIInChI=1S/C10H13BrN2O/c1-6-3-8(13-9(14)5-12)4-7(2)10(6)11/h3-4H,5,12H2,1-2H3,(H,13,14)
InChIKeyHQVRIVBFPMUXQV-UHFFFAOYSA-N
XLogP1.96
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(4-bromo-3,5-dimethylphenyl)pentanamide
CID 107574314
N-(4-bromo-3,5-dimethylphenyl)-3,3-dimethylbutanamide
CID 107574880
5-bromo-N-(4-bromo-3,5-dimethylphenyl)pentanamide
CID 66818039
2-amino-N-(4-ethyl-3-methylphenyl)acetamide
CID 130495605
(2S)-2-amino-N-[2-(4-bromo-3,5-dimethylanilino)-2-oxoethyl]-3-methylbutanamide
CID 107574189
N-(4-bromo-3,5-dimethylphenyl)-3-(propan-2-ylamino)propanamide
CID 107574235
(2S)-2-amino-N-(4-bromo-3,5-dimethylphenyl)propanamide
CID 107574322
2-amino-N-[2-(3,5-dimethylanilino)-2-oxoethyl]acetamide
CID 60848808
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
2-(4-bromo-3,5-dimethylanilino)-N-phenylacetamide
CID 107573643
N-(4-bromo-3-fluoro-5-methylphenyl)-2-chloroacetamide
CID 167237399
2-(4-bromo-3,5-dimethylanilino)-N-(4-methylphenyl)acetamide
CID 107573574

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide?
The IUPAC name of 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide (CID 107574130) is 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide is Cc1cc(NC(=O)CN)cc(C)c1Br.
What is the InChIKey of 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide?
The InChIKey is HQVRIVBFPMUXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O/c1-6-3-8(13-9(14)5-12)4-7(2)10(6)11/h3-4H,5,12H2,1-2H3,(H,13,14).
What are the key properties of 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide?
2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide has a molecular weight of 257.13 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-bromo-3,5-dimethylphenyl)acetamide is sourced from PubChem (CID 107574130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).