2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide

C15H23NO2 — CID 112604884

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)COC(C)(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-11(2)12-6-8-13(9-7-12)16-14(17)10-18-15(3,4)5/h6-9,11H,10H2,1-5H3,(H,16,17)
InChIKeyKHPLQUXKGWCIMP-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.56
Rot. Bonds4

About 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide

2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 112604884) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide
PubChem CID112604884
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NC(=O)COC(C)(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-11(2)12-6-8-13(9-7-12)16-14(17)10-18-15(3,4)5/h6-9,11H,10H2,1-5H3,(H,16,17)
InChIKeyKHPLQUXKGWCIMP-UHFFFAOYSA-N
XLogP3.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[4-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
CID 115950293
methyl N-[4-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]carbamate
CID 115949974
N-[4-(hydroxymethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603178
2-[(2-methylpropan-2-yl)oxy]-N-[(4-propan-2-ylphenyl)methyl]acetamide
CID 112605367
N-[4-(dimethylamino)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605077
methyl 4-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]benzoate
CID 112603565
cis-[2-oxo-2-(4-propan-2-ylanilino)ethyl] (1S,2R)-2-methylcyclopropane-1-carboxylate
CID 7778091
2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 39448754
2-(3,5-dimethoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 7707185
2-iodo-N-(4-propan-2-ylphenyl)acetamide
CID 60723215
3-amino-3-methyl-N-(4-propan-2-ylphenyl)butanamide
CID 64683934
N-[4-(2-bromoethyl)phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604146

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide (CID 112604884) is 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(NC(=O)COC(C)(C)C)cc1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is KHPLQUXKGWCIMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(2)12-6-8-13(9-7-12)16-14(17)10-18-15(3,4)5/h6-9,11H,10H2,1-5H3,(H,16,17).
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 249.35 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 112604884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).