2-(3-acetamido-4-ethoxyphenyl)acetamide

C12H16N2O3 — CID 96674142

IUPAC2-(3-acetamido-4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(N)=O)cc1NC(C)=O
InChIInChI=1S/C12H16N2O3/c1-3-17-11-5-4-9(7-12(13)16)6-10(11)14-8(2)15/h4-6H,3,7H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyVWTQMJURROQAPU-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.07
Rot. Bonds5

About 2-(3-acetamido-4-ethoxyphenyl)acetamide

2-(3-acetamido-4-ethoxyphenyl)acetamide (PubChem CID 96674142) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-(3-acetamido-4-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetamido-4-ethoxyphenyl)acetamide
PubChem CID96674142
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name2-(3-acetamido-4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(N)=O)cc1NC(C)=O
InChIInChI=1S/C12H16N2O3/c1-3-17-11-5-4-9(7-12(13)16)6-10(11)14-8(2)15/h4-6H,3,7H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyVWTQMJURROQAPU-UHFFFAOYSA-N
XLogP1.07
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-acetamido-4-ethoxyphenyl)acetamide 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-ethoxy-5-(2-oxopropyl)phenyl]acetamide
CID 96673990
N-[2-ethoxy-5-(hydroxymethyl)phenyl]acetamide
CID 82470650
N-[2-ethoxy-5-[2-(methanesulfonamido)ethyl]phenyl]acetamide
CID 110790279
N-[5-(3-cyanopropyl)-2-ethoxyphenyl]acetamide
CID 98015653
3-acetamido-4-ethoxybenzenesulfonic acid
CID 82483875
N-[3-(aminomethyl)-4-ethoxyphenyl]acetamide
CID 63755124
1-(3-amino-4-ethoxyphenyl)propan-2-one
CID 54371004
(E)-N-[4-(2-amino-2-oxoethyl)phenyl]-3-(3-ethoxy-4-methoxyphenyl)prop-2-enamide
CID 55620260
N-[2-acetamido-4-[(2Z)-2-amino-2-hydroxyiminoethyl]phenyl]acetamide
CID 134117290
N-[5-(3-amino-1H-pyrazol-5-yl)-2-ethoxyphenyl]acetamide
CID 82484529
N-[5-(6-aminopyrimidin-4-yl)-2-ethoxyphenyl]acetamide
CID 96668388
N-[2-ethoxy-5-[1-hydroxy-2-(methylamino)ethyl]phenyl]acetamide
CID 112514063

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamido-4-ethoxyphenyl)acetamide?
The IUPAC name of 2-(3-acetamido-4-ethoxyphenyl)acetamide (CID 96674142) is 2-(3-acetamido-4-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-acetamido-4-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(3-acetamido-4-ethoxyphenyl)acetamide is CCOc1ccc(CC(N)=O)cc1NC(C)=O.
What is the InChIKey of 2-(3-acetamido-4-ethoxyphenyl)acetamide?
The InChIKey is VWTQMJURROQAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-3-17-11-5-4-9(7-12(13)16)6-10(11)14-8(2)15/h4-6H,3,7H2,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 2-(3-acetamido-4-ethoxyphenyl)acetamide?
2-(3-acetamido-4-ethoxyphenyl)acetamide has a molecular weight of 236.27 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamido-4-ethoxyphenyl)acetamide is sourced from PubChem (CID 96674142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).