N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

C14H21NO2 — CID 112604369

IUPACN-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCc1ccc(NC(=O)COC(C)(C)C)c(C)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-12(11(2)8-10)15-13(16)9-17-14(3,4)5/h6-8H,9H2,1-5H3,(H,15,16)
InChIKeyZPGKQCKRDBWIRP-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.06
Rot. Bonds3

About N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112604369) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112604369
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCc1ccc(NC(=O)COC(C)(C)C)c(C)c1
InChIInChI=1S/C14H21NO2/c1-10-6-7-12(11(2)8-10)15-13(16)9-17-14(3,4)5/h6-8H,9H2,1-5H3,(H,15,16)
InChIKeyZPGKQCKRDBWIRP-UHFFFAOYSA-N
XLogP3.06
TPSA38.33 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 ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-iodo-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604433
N-(2-methoxy-4-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604669
N-(5-chloro-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604822
[2-(2,4-dimethylanilino)-2-oxoethyl] 2-methoxyacetate
CID 7776162
4-[2-(2,4-dimethylanilino)-2-oxoethoxy]benzoic acid
CID 4026014
2-(3-tert-butylphenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 112977615
N-(3-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604930
N-(5-acetamido-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950028
N-(2,4-dimethylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 625191
N-(2,4-dimethylphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093188
2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 874144
[2-(2,4-dimethylanilino)-2-oxoethyl] 2-(4-tert-butylphenoxy)acetate
CID 7855552

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112604369) is N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is Cc1ccc(NC(=O)COC(C)(C)C)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is ZPGKQCKRDBWIRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-6-7-12(11(2)8-10)15-13(16)9-17-14(3,4)5/h6-8H,9H2,1-5H3,(H,15,16).
What are the key properties of N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 235.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112604369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).