N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide

C15H22N2O3 — CID 110437825

IUPACN-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)NCCNC(C)=O)cc1
InChIInChI=1S/C15H22N2O3/c1-11(18)16-9-10-17-14(19)15(2,3)12-5-7-13(20-4)8-6-12/h5-8H,9-10H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyFGQOVLWLMAKUMB-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.23
Rot. Bonds6

About N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide

N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 110437825) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID110437825
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(C)(C)C(=O)NCCNC(C)=O)cc1
InChIInChI=1S/C15H22N2O3/c1-11(18)16-9-10-17-14(19)15(2,3)12-5-7-13(20-4)8-6-12/h5-8H,9-10H2,1-4H3,(H,16,18)(H,17,19)
InChIKeyFGQOVLWLMAKUMB-UHFFFAOYSA-N
XLogP1.23
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
CID 110678562
N-[2-(4-methoxyphenyl)ethyl]-2-methyl-2-(4-methylphenyl)propanamide
CID 113198054
N-(2-acetamidoethyl)-4-methoxybenzamide
CID 30596623
2-(4-methoxyphenyl)-2-methyl-N-[4-(4-methylpiperazin-1-yl)butyl]propanamide
CID 110437822
N-[2-(cyclohexen-1-yl)ethyl]-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110437770
N-(1-hydroxy-2-methylpropan-2-yl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110466111
2-(4-methoxyphenyl)-2-methyl-N-[3-(4-methyl-1,3-thiazol-2-yl)propyl]propanamide
CID 110446423
2-(4-methoxyphenyl)-2-methyl-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]propanamide
CID 110446439
N-(3-acetamidophenyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110438763
N-[3-(4-methoxyphenoxy)propyl]acetamide
CID 60578635
4-methoxy-N-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]benzamide
CID 108537590
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methoxyphenoxy)ethyl]-2-methylpropanamide
CID 113197929

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide (CID 110437825) is N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(C)(C)C(=O)NCCNC(C)=O)cc1.
What is the InChIKey of N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is FGQOVLWLMAKUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11(18)16-9-10-17-14(19)15(2,3)12-5-7-13(20-4)8-6-12/h5-8H,9-10H2,1-4H3,(H,16,18)(H,17,19).
What are the key properties of N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide?
N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 278.35 g/mol, XLogP of 1.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 110437825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).