2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride

C11H17ClN2O — CID 12546858

IUPAC2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
SMILESCc1cc(C)c(NC(=O)CN)c(C)c1.Cl
InChIInChI=1S/C11H16N2O.ClH/c1-7-4-8(2)11(9(3)5-7)13-10(14)6-12;/h4-5H,6,12H2,1-3H3,(H,13,14);1H
InChIKeyAFAZOFONKQSJFB-UHFFFAOYSA-N
MW228.72 g/mol
LogP1.93
Rot. Bonds2

About 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride

2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride (PubChem CID 12546858) has the molecular formula C11H17ClN2O and a molecular weight of 228.72 g/mol. Its IUPAC name is 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
PubChem CID12546858
Molecular FormulaC11H17ClN2O
Molecular Weight228.72 g/mol
Exact Mass228.10
IUPAC Name2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
SMILESCc1cc(C)c(NC(=O)CN)c(C)c1.Cl
InChIInChI=1S/C11H16N2O.ClH/c1-7-4-8(2)11(9(3)5-7)13-10(14)6-12;/h4-5H,6,12H2,1-3H3,(H,13,14);1H
InChIKeyAFAZOFONKQSJFB-UHFFFAOYSA-N
XLogP1.93
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.72
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride (CID 12546858) is 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride is Cc1cc(C)c(NC(=O)CN)c(C)c1.Cl.
What is the InChIKey of 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride?
The InChIKey is AFAZOFONKQSJFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O.ClH/c1-7-4-8(2)11(9(3)5-7)13-10(14)6-12;/h4-5H,6,12H2,1-3H3,(H,13,14);1H.
What are the key properties of 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride?
2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride has a molecular weight of 228.72 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 12546858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).