2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide

C17H26N2O — CID 171998632

IUPAC2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CN(C)CC2CCC2)c(C)c1
InChIInChI=1S/C17H26N2O/c1-12-8-13(2)17(14(3)9-12)18-16(20)11-19(4)10-15-6-5-7-15/h8-9,15H,5-7,10-11H2,1-4H3,(H,18,20)
InChIKeyBBKQGLBKFLYUSY-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.28
Rot. Bonds5

About 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide

2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 171998632) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID171998632
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(NC(=O)CN(C)CC2CCC2)c(C)c1
InChIInChI=1S/C17H26N2O/c1-12-8-13(2)17(14(3)9-12)18-16(20)11-19(4)10-15-6-5-7-15/h8-9,15H,5-7,10-11H2,1-4H3,(H,18,20)
InChIKeyBBKQGLBKFLYUSY-UHFFFAOYSA-N
XLogP3.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[methyl(piperidin-4-ylmethyl)amino]-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 119930334
N-(2-chloro-4,6-dimethylphenyl)-3-[cyclobutylmethyl(methyl)amino]propanamide
CID 91834471
2-[cyclohexyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 4818302
2-[cycloheptyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 16577746
N-(4-amino-2,6-dichlorophenyl)-2-[cyclobutylmethyl(methyl)amino]acetamide
CID 62861622
2-[[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 11930399
2-[[2-[cyclopropylmethyl(propyl)amino]-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 8621837
N-[(1S,2S)-2-methylcyclohexyl]-2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 11939314
2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 9338949
2-[[2-[[(1R)-1-cyclopropylethyl]amino]-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 8622732
2-(dimethylamino)-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 138400573
N-(2,6-dimethylphenyl)-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 103815623

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide (CID 171998632) is 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide is Cc1cc(C)c(NC(=O)CN(C)CC2CCC2)c(C)c1.
What is the InChIKey of 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is BBKQGLBKFLYUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12-8-13(2)17(14(3)9-12)18-16(20)11-19(4)10-15-6-5-7-15/h8-9,15H,5-7,10-11H2,1-4H3,(H,18,20).
What are the key properties of 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide?
2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutylmethyl(methyl)amino]-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 171998632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).