2-(2,4-ditert-butylphenyl)acetamide

C16H25NO — CID 134462410

IUPAC2-(2,4-ditert-butylphenyl)acetamide
SMILESCC(C)(C)c1ccc(CC(N)=O)c(C(C)(C)C)c1
InChIInChI=1S/C16H25NO/c1-15(2,3)12-8-7-11(9-14(17)18)13(10-12)16(4,5)6/h7-8,10H,9H2,1-6H3,(H2,17,18)
InChIKeyIHLHZWPGOLGYRB-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.31
Rot. Bonds2

About 2-(2,4-ditert-butylphenyl)acetamide

2-(2,4-ditert-butylphenyl)acetamide (PubChem CID 134462410) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2-(2,4-ditert-butylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-ditert-butylphenyl)acetamide
PubChem CID134462410
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2-(2,4-ditert-butylphenyl)acetamide
SMILESCC(C)(C)c1ccc(CC(N)=O)c(C(C)(C)C)c1
InChIInChI=1S/C16H25NO/c1-15(2,3)12-8-7-11(9-14(17)18)13(10-12)16(4,5)6/h7-8,10H,9H2,1-6H3,(H2,17,18)
InChIKeyIHLHZWPGOLGYRB-UHFFFAOYSA-N
XLogP3.31
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,4-ditert-butylphenyl)methanamine
CID 174492091
2-(aminomethyl)-5-tert-butylbenzamide
CID 140516367
2-(2,4-ditert-butylphenyl)ethanesulfonic acid
CID 87653865
2-(6-tert-butyl-2-methylquinolin-4-yl)acetamide
CID 82575406
1-(3,5-ditert-butyl-4-hydroxyphenyl)-3-(2,4-ditert-butylphenyl)propan-1-one
CID 118518907
(2,4-ditert-butylphenoxy)methyl hydrogen carbonate
CID 145055436
4-(2,4-ditert-butylphenyl)-3-[(2,4-ditert-butylphenyl)methyl]-2,2-bis(hydroxymethyl)butane-1,3-diol
CID 141440225
4-tert-butyl-2-[2-(5-tert-butyl-2-carbamoylphenyl)ethyl]benzamide
CID 22177478
2-(8-tert-butyl-2-methylquinolin-4-yl)acetamide
CID 82575405
2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide
CID 82496629
3-[1-[4-(2-amino-2-oxoethyl)-3-tert-butylphenyl]-2-methylpropan-2-yl]-N-cyclopropylbenzamide
CID 134476073
ethyl 2-[4-tert-butyl-2-(2-ethoxy-2-oxoethyl)phenyl]acetate
CID 140674164

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-ditert-butylphenyl)acetamide?
The IUPAC name of 2-(2,4-ditert-butylphenyl)acetamide (CID 134462410) is 2-(2,4-ditert-butylphenyl)acetamide.
What is the SMILES notation for 2-(2,4-ditert-butylphenyl)acetamide?
The canonical SMILES for 2-(2,4-ditert-butylphenyl)acetamide is CC(C)(C)c1ccc(CC(N)=O)c(C(C)(C)C)c1.
What is the InChIKey of 2-(2,4-ditert-butylphenyl)acetamide?
The InChIKey is IHLHZWPGOLGYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-15(2,3)12-8-7-11(9-14(17)18)13(10-12)16(4,5)6/h7-8,10H,9H2,1-6H3,(H2,17,18).
What are the key properties of 2-(2,4-ditert-butylphenyl)acetamide?
2-(2,4-ditert-butylphenyl)acetamide has a molecular weight of 247.38 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-ditert-butylphenyl)acetamide is sourced from PubChem (CID 134462410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).