N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide

C15H24N2O — CID 54812139

IUPACN-tert-butyl-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cc(C)c(NCC(=O)NC(C)(C)C)c(C)c1
InChIInChI=1S/C15H24N2O/c1-10-7-11(2)14(12(3)8-10)16-9-13(18)17-15(4,5)6/h7-8,16H,9H2,1-6H3,(H,17,18)
InChIKeyQAVVWQMNROWFTN-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.94
Rot. Bonds3

About N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide

N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide (PubChem CID 54812139) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(2,4,6-trimethylanilino)acetamide
PubChem CID54812139
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-tert-butyl-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cc(C)c(NCC(=O)NC(C)(C)C)c(C)c1
InChIInChI=1S/C15H24N2O/c1-10-7-11(2)14(12(3)8-10)16-9-13(18)17-15(4,5)6/h7-8,16H,9H2,1-6H3,(H,17,18)
InChIKeyQAVVWQMNROWFTN-UHFFFAOYSA-N
XLogP2.94
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(2,4,6-trimethylanilino)acetamide
CID 54812059
N-tert-butyl-2-[(2,4,6-trimethylphenyl)methylamino]acetamide
CID 47177896
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 34162909
N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
CID 54812168
[2-(tert-butylamino)-2-oxoethyl]-ethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium
CID 8796431
2-(2-amino-6-methylanilino)-N-tert-butylacetamide
CID 115550766
2-(4-bromo-2,6-dimethylanilino)-N-(2-methylbutan-2-yl)acetamide
CID 61063414
N-[2-(dimethylamino)ethyl]-2-(2,4,6-trimethylanilino)acetamide
CID 108994656
N-(3-methoxypropyl)-2-(2,4,6-trimethylanilino)acetamide
CID 54811773
2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide
CID 113169988
N-[2-[[2-(tert-butylamino)-2-oxoethyl]amino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 26456891
N-tert-butyl-2-[(6-methylpyrimidin-4-yl)amino]acetamide
CID 78954650

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide?
The IUPAC name of N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide (CID 54812139) is N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide?
The canonical SMILES for N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide is Cc1cc(C)c(NCC(=O)NC(C)(C)C)c(C)c1.
What is the InChIKey of N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide?
The InChIKey is QAVVWQMNROWFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10-7-11(2)14(12(3)8-10)16-9-13(18)17-15(4,5)6/h7-8,16H,9H2,1-6H3,(H,17,18).
What are the key properties of N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide?
N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide is sourced from PubChem (CID 54812139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).