N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide

C12H17NO4 — CID 94687467

IUPACN-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide
SMILESCOc1ccc(CCNC(=O)CO)c(OC)c1
InChIInChI=1S/C12H17NO4/c1-16-10-4-3-9(11(7-10)17-2)5-6-13-12(15)8-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyUKNFEIKCUQURMK-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.35
Rot. Bonds6

About N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide

N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide (PubChem CID 94687467) has the molecular formula C12H17NO4 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide
PubChem CID94687467
Molecular FormulaC12H17NO4
Molecular Weight239.27 g/mol
Exact Mass239.12
IUPAC NameN-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide
SMILESCOc1ccc(CCNC(=O)CO)c(OC)c1
InChIInChI=1S/C12H17NO4/c1-16-10-4-3-9(11(7-10)17-2)5-6-13-12(15)8-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15)
InChIKeyUKNFEIKCUQURMK-UHFFFAOYSA-N
XLogP0.35
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide 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-(2,4-dimethoxyphenyl)ethyl]-3-sulfanylpropanamide
CID 115168006
N-[2-(2,4-dimethoxyphenyl)ethyl]-3-methylsulfonylpropanamide
CID 110607051
2-(4-chlorophenoxy)-N-[2-(2,4-dimethoxyphenyl)ethyl]acetamide
CID 110601482
2-(2,4-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
CID 43389932
N-[2-(2,4-dimethoxyphenyl)ethyl]-2-ethylbutanamide
CID 110408765
1-[2-(2,4-dimethoxyphenyl)ethyl]-3-[2-(2-methoxyphenyl)ethyl]urea
CID 110408905
3-[2-(2,4-dimethoxyphenyl)ethyl]-1,1-diethylurea
CID 110601497
N-[2-(2,4-dimethoxyphenyl)ethyl]-4-phenoxybutanamide
CID 110601484
4-[3-[2-(2,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]benzoic acid
CID 119182295
N-[2-(2,5-dimethoxy-4-methylphenyl)ethyl]-2-hydroxyacetamide
CID 115140079
N-(2-acetamidoethyl)-2-(2,4-dimethoxyphenyl)acetamide
CID 30597310
N-[3-(4-bromo-2-methoxyphenyl)propyl]-2-hydroxyacetamide
CID 75503918

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide?
The IUPAC name of N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide (CID 94687467) is N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide.
What is the SMILES notation for N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide?
The canonical SMILES for N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide is COc1ccc(CCNC(=O)CO)c(OC)c1.
What is the InChIKey of N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide?
The InChIKey is UKNFEIKCUQURMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4/c1-16-10-4-3-9(11(7-10)17-2)5-6-13-12(15)8-14/h3-4,7,14H,5-6,8H2,1-2H3,(H,13,15).
What are the key properties of N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide?
N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide has a molecular weight of 239.27 g/mol, XLogP of 0.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethoxyphenyl)ethyl]-2-hydroxyacetamide is sourced from PubChem (CID 94687467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).