N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide

C14H21NO — CID 110767844

IUPACN-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(CC(=O)NC(C)C)c(C)c1
InChIInChI=1S/C14H21NO/c1-9(2)15-14(16)8-13-11(4)6-10(3)7-12(13)5/h6-7,9H,8H2,1-5H3,(H,15,16)
InChIKeyVCCVETWOYPTWBD-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.68
Rot. Bonds3

About N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide

N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide (PubChem CID 110767844) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide
PubChem CID110767844
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide
SMILESCc1cc(C)c(CC(=O)NC(C)C)c(C)c1
InChIInChI=1S/C14H21NO/c1-9(2)15-14(16)8-13-11(4)6-10(3)7-12(13)5/h6-7,9H,8H2,1-5H3,(H,15,16)
InChIKeyVCCVETWOYPTWBD-UHFFFAOYSA-N
XLogP2.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-hydroxy-2-(2,4,6-trimethylphenyl)acetamide
CID 139860051
N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
CID 116847434
N-(1-cyanobutan-2-yl)-2-(2,4,6-trimethylphenyl)acetamide
CID 22075936
ethyl 4-methylsulfanyl-2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]butanoate
CID 19785904
N-phenyl-2-(2,4,6-trimethylphenyl)acetamide
CID 42390776
2-(4-chloro-2-methylphenyl)-N-propan-2-ylacetamide
CID 171546068
N-[(2S)-3-methylbutan-2-yl]-4-[2-(2,4,6-trimethylphenyl)acetyl]benzamide
CID 101424780
2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]ethyl carbamate
CID 86787902
2-(propan-2-ylamino)-N-[2-(2,4,6-trimethylphenyl)ethyl]acetamide
CID 115158305
methyl-[2-oxo-2-(propan-2-ylamino)ethyl]-[(2S)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]azanium
CID 9049949
2-phenyl-3-[[2-(2,4,6-trimethylphenyl)acetyl]amino]propanoic acid
CID 120528796
methyl (2S)-2-hydroxy-2-methyl-3-[[2-(2,4,6-trimethylphenyl)acetyl]amino]propanoate
CID 129358755

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide (CID 110767844) is N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide is Cc1cc(C)c(CC(=O)NC(C)C)c(C)c1.
What is the InChIKey of N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is VCCVETWOYPTWBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9(2)15-14(16)8-13-11(4)6-10(3)7-12(13)5/h6-7,9H,8H2,1-5H3,(H,15,16).
What are the key properties of N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide?
N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 219.33 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 110767844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).