2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide

C14H21NO2 — CID 82496629

IUPAC2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide
SMILESCOc1cc(C)c(CC(N)=O)cc1C(C)(C)C
InChIInChI=1S/C14H21NO2/c1-9-6-12(17-5)11(14(2,3)4)7-10(9)8-13(15)16/h6-7H,8H2,1-5H3,(H2,15,16)
InChIKeyZFCAMZPSJPKHJF-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.33
Rot. Bonds3

About 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide

2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide (PubChem CID 82496629) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide
PubChem CID82496629
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide
SMILESCOc1cc(C)c(CC(N)=O)cc1C(C)(C)C
InChIInChI=1S/C14H21NO2/c1-9-6-12(17-5)11(14(2,3)4)7-10(9)8-13(15)16/h6-7H,8H2,1-5H3,(H2,15,16)
InChIKeyZFCAMZPSJPKHJF-UHFFFAOYSA-N
XLogP2.33
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]acetamide
CID 96678465
2-(4,5-dimethoxy-2-methylphenyl)acetyl chloride
CID 91113458
N-[2-(5-tert-butyl-4-methoxy-2-methylphenyl)ethyl]ethanesulfonamide
CID 110788400
1-(5-tert-butyl-4-methoxy-2-methylphenyl)-3-methoxypropan-1-one
CID 82053745
4-(5-tert-butyl-4-methoxy-2-methylphenyl)butanenitrile
CID 96662662
[2-(2,5-dimethoxy-4-methylphenyl)-2-methylpropyl]urea
CID 115168800
5-(5-tert-butyl-4-methoxy-2-methylphenyl)pentanenitrile
CID 98017001
4-(4-tert-butyl-5-methoxy-2-methylphenyl)butan-1-amine
CID 117377717
2-(5-tert-butyl-4-methoxy-2-methylphenyl)-2-hydroxyacetic acid
CID 82481489
4-tert-butyl-5-methoxy-2-methylaniline
CID 59687322
(E)-4-(5-tert-butyl-4-methoxy-2-methylphenyl)but-3-enoic acid
CID 82302728
5-tert-butyl-N-(cyanomethyl)-4-methoxy-2-methylbenzamide
CID 82484656

Frequently Asked Questions

What is the IUPAC name of 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide?
The IUPAC name of 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide (CID 82496629) is 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide?
The canonical SMILES for 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide is COc1cc(C)c(CC(N)=O)cc1C(C)(C)C.
What is the InChIKey of 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide?
The InChIKey is ZFCAMZPSJPKHJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-9-6-12(17-5)11(14(2,3)4)7-10(9)8-13(15)16/h6-7H,8H2,1-5H3,(H2,15,16).
What are the key properties of 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide?
2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-tert-butyl-4-methoxy-2-methylphenyl)acetamide is sourced from PubChem (CID 82496629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).