2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide

C16H15Cl2NO4 — CID 55638249

IUPAC2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide
SMILESCOc1cc(CNC(=O)COc2ccc(Cl)c(Cl)c2)ccc1O
InChIInChI=1S/C16H15Cl2NO4/c1-22-15-6-10(2-5-14(15)20)8-19-16(21)9-23-11-3-4-12(17)13(18)7-11/h2-7,20H,8-9H2,1H3,(H,19,21)
InChIKeyOJMHDSSMIDXCCO-UHFFFAOYSA-N
MW356.21 g/mol
LogP3.40
Rot. Bonds6

About 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide

2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide (PubChem CID 55638249) has the molecular formula C16H15Cl2NO4 and a molecular weight of 356.21 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide
PubChem CID55638249
Molecular FormulaC16H15Cl2NO4
Molecular Weight356.21 g/mol
Exact Mass355.04
IUPAC Name2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide
SMILESCOc1cc(CNC(=O)COc2ccc(Cl)c(Cl)c2)ccc1O
InChIInChI=1S/C16H15Cl2NO4/c1-22-15-6-10(2-5-14(15)20)8-19-16(21)9-23-11-3-4-12(17)13(18)7-11/h2-7,20H,8-9H2,1H3,(H,19,21)
InChIKeyOJMHDSSMIDXCCO-UHFFFAOYSA-N
XLogP3.40
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.21
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]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

2-(3,4-dichlorophenoxy)-N-[(4-ethoxy-3-methoxyphenyl)methyl]acetamide
CID 55660605
N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-(4-phenoxyphenoxy)acetamide
CID 55638373
2-(3-chlorophenoxy)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 2707667
N-[(3,4-dihydroxyphenyl)methyl]-2-(4-hydroxy-3-methoxyphenyl)acetamide
CID 10063540
2-(3,4-dichlorophenoxy)-N-[[3-(propan-2-yloxymethyl)phenyl]methyl]acetamide
CID 55797782
3-(2,3-dichlorophenyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]propanamide
CID 55690888
2-(4-chlorophenoxy)-N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]acetamide
CID 47042624
N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(3-oxobutyl)phenoxy]acetamide
CID 2568679
N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
CID 809048
2-(4-chloro-3-ethylphenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 18074796
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 27894841
N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methoxyphenoxy)acetamide
CID 7928589

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide (CID 55638249) is 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide is COc1cc(CNC(=O)COc2ccc(Cl)c(Cl)c2)ccc1O.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide?
The InChIKey is OJMHDSSMIDXCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO4/c1-22-15-6-10(2-5-14(15)20)8-19-16(21)9-23-11-3-4-12(17)13(18)7-11/h2-7,20H,8-9H2,1H3,(H,19,21).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide?
2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide has a molecular weight of 356.21 g/mol, XLogP of 3.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenoxy)-N-[(4-hydroxy-3-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 55638249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).