2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide

C17H26N2O2 — CID 113169988

IUPAC2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide
SMILESCC(=O)N(CC(=O)NC(C)(C)C)c1c(C)cc(C)cc1C
InChIInChI=1S/C17H26N2O2/c1-11-8-12(2)16(13(3)9-11)19(14(4)20)10-15(21)18-17(5,6)7/h8-9H,10H2,1-7H3,(H,18,21)
InChIKeyXIKBICFDRCETRS-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.88
Rot. Bonds3

About 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide

2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide (PubChem CID 113169988) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide
PubChem CID113169988
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide
SMILESCC(=O)N(CC(=O)NC(C)(C)C)c1c(C)cc(C)cc1C
InChIInChI=1S/C17H26N2O2/c1-11-8-12(2)16(13(3)9-11)19(14(4)20)10-15(21)18-17(5,6)7/h8-9H,10H2,1-7H3,(H,18,21)
InChIKeyXIKBICFDRCETRS-UHFFFAOYSA-N
XLogP2.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,4,6-trimethylanilino)-N-(4-methylphenyl)acetamide
CID 113170003
2-(N-acetyl-2,4,6-trimethylanilino)-N-prop-2-enylacetamide
CID 113169920
2-(N-acetyl-2-bromo-4-methylanilino)-N-tert-butylacetamide
CID 113178016
2-(N-acetyl-2,4,6-trimethylanilino)-N-(3,5-dichlorophenyl)acetamide
CID 113170075
2-[N-acetyl-2,6-di(propan-2-yl)anilino]-N-tert-butylacetamide
CID 113178588
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 34162909
2-(N-acetyl-2,4,6-trimethylanilino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113170050
2-(N-acetyl-4-bromoanilino)-N-tert-butylacetamide
CID 113172965
N-tert-butyl-2-(2,4,6-trimethylanilino)acetamide
CID 54812139
N-tert-butyl-2-[methyl-[2-(2,4,6-trimethylphenyl)sulfanylacetyl]amino]acetamide
CID 8682254
N-tert-butyl-2-[methyl-[2-(2,4,6-trimethylphenoxy)acetyl]amino]acetamide
CID 24660351
2-(N-acetyl-3,4-dimethoxyanilino)-N-tert-butylacetamide
CID 113174873

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide?
The IUPAC name of 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide (CID 113169988) is 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide.
What is the SMILES notation for 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide?
The canonical SMILES for 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide is CC(=O)N(CC(=O)NC(C)(C)C)c1c(C)cc(C)cc1C.
What is the InChIKey of 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide?
The InChIKey is XIKBICFDRCETRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-11-8-12(2)16(13(3)9-11)19(14(4)20)10-15(21)18-17(5,6)7/h8-9H,10H2,1-7H3,(H,18,21).
What are the key properties of 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide?
2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,4,6-trimethylanilino)-N-tert-butylacetamide is sourced from PubChem (CID 113169988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).