2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide

C19H22ClNO4 — CID 55801251

IUPAC2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide
SMILESCOCCOc1cccc(CNC(=O)COCc2ccccc2Cl)c1
InChIInChI=1S/C19H22ClNO4/c1-23-9-10-25-17-7-4-5-15(11-17)12-21-19(22)14-24-13-16-6-2-3-8-18(16)20/h2-8,11H,9-10,12-14H2,1H3,(H,21,22)
InChIKeyUAVFRUNVQDEKOJ-UHFFFAOYSA-N
MW363.84 g/mol
LogP3.20
Rot. Bonds10

About 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide

2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide (PubChem CID 55801251) has the molecular formula C19H22ClNO4 and a molecular weight of 363.84 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide
PubChem CID55801251
Molecular FormulaC19H22ClNO4
Molecular Weight363.84 g/mol
Exact Mass363.12
IUPAC Name2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide
SMILESCOCCOc1cccc(CNC(=O)COCc2ccccc2Cl)c1
InChIInChI=1S/C19H22ClNO4/c1-23-9-10-25-17-7-4-5-15(11-17)12-21-19(22)14-24-13-16-6-2-3-8-18(16)20/h2-8,11H,9-10,12-14H2,1H3,(H,21,22)
InChIKeyUAVFRUNVQDEKOJ-UHFFFAOYSA-N
XLogP3.20
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.84
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide (CID 55801251) is 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide is COCCOc1cccc(CNC(=O)COCc2ccccc2Cl)c1.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide?
The InChIKey is UAVFRUNVQDEKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO4/c1-23-9-10-25-17-7-4-5-15(11-17)12-21-19(22)14-24-13-16-6-2-3-8-18(16)20/h2-8,11H,9-10,12-14H2,1H3,(H,21,22).
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide?
2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide has a molecular weight of 363.84 g/mol, XLogP of 3.20, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 55801251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).