N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide

C13H17NO3 — CID 113233232

IUPACN-(4-acetylphenyl)-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C13H17NO3/c1-9(15)10-5-7-11(8-6-10)14-12(16)13(2,3)17-4/h5-8H,1-4H3,(H,14,16)
InChIKeyYGEMMWHDXLUWOZ-UHFFFAOYSA-N
MW235.28 g/mol
LogP2.25
Rot. Bonds4

About N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide

N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide (PubChem CID 113233232) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-methoxy-2-methylpropanamide
PubChem CID113233232
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC NameN-(4-acetylphenyl)-2-methoxy-2-methylpropanamide
SMILESCOC(C)(C)C(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C13H17NO3/c1-9(15)10-5-7-11(8-6-10)14-12(16)13(2,3)17-4/h5-8H,1-4H3,(H,14,16)
InChIKeyYGEMMWHDXLUWOZ-UHFFFAOYSA-N
XLogP2.25
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[[3-(4-acetylanilino)-2,2-dimethyl-3-oxopropanoyl]amino]benzoate
CID 108969758
N-(4-formylphenyl)-2-methoxy-2-methylpropanamide
CID 106912194
N-(4-acetylphenyl)-3-amino-2,2,3-trimethylbutanamide
CID 65269737
2-methoxy-2-methyl-N-[4-(trifluoromethyl)phenyl]propanamide
CID 18709942
N-(3-acetylphenyl)-N'-(4-acetylphenyl)-2,2-dimethylpropanediamide
CID 108969722
methyl N-(4-acetylphenyl)carbamate;propane
CID 177246404
N-(4-acetylphenyl)-2,2,4,4-tetramethylpentanamide
CID 143619432
N-(4-acetylphenyl)-N'-(4-chlorophenyl)-2,2-dimethylpropanediamide
CID 108968994
N-(4-acetylphenyl)-2-hydroxy-2,2-diphenylacetamide
CID 12522226
N-[4-(2-hydroxyethyl)phenyl]-2-methoxy-2-methylpropanamide
CID 103771888
2-[4-[(2-methoxy-2-methylpropanoyl)amino]phenyl]acetic acid
CID 113424569
N-(4-acetylphenyl)-2,2-dimethyl-N'-propan-2-ylpropanediamide
CID 108957314

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide?
The IUPAC name of N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide (CID 113233232) is N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide is COC(C)(C)C(=O)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide?
The InChIKey is YGEMMWHDXLUWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-9(15)10-5-7-11(8-6-10)14-12(16)13(2,3)17-4/h5-8H,1-4H3,(H,14,16).
What are the key properties of N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide?
N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide has a molecular weight of 235.28 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-methoxy-2-methylpropanamide is sourced from PubChem (CID 113233232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).