2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide

C19H23NO4 — CID 133219180

IUPAC2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide
SMILESCOc1ccccc1OC(C)C(=O)NCCOc1cccc(C)c1
InChIInChI=1S/C19H23NO4/c1-14-7-6-8-16(13-14)23-12-11-20-19(21)15(2)24-18-10-5-4-9-17(18)22-3/h4-10,13,15H,11-12H2,1-3H3,(H,20,21)
InChIKeyCRNJLTNDWVYJFB-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.97
Rot. Bonds8

About 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide

2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide (PubChem CID 133219180) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide
PubChem CID133219180
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide
SMILESCOc1ccccc1OC(C)C(=O)NCCOc1cccc(C)c1
InChIInChI=1S/C19H23NO4/c1-14-7-6-8-16(13-14)23-12-11-20-19(21)15(2)24-18-10-5-4-9-17(18)22-3/h4-10,13,15H,11-12H2,1-3H3,(H,20,21)
InChIKeyCRNJLTNDWVYJFB-UHFFFAOYSA-N
XLogP2.97
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.97
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-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide (CID 133219180) is 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide is COc1ccccc1OC(C)C(=O)NCCOc1cccc(C)c1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide?
The InChIKey is CRNJLTNDWVYJFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-14-7-6-8-16(13-14)23-12-11-20-19(21)15(2)24-18-10-5-4-9-17(18)22-3/h4-10,13,15H,11-12H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide?
2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide has a molecular weight of 329.40 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide is sourced from PubChem (CID 133219180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).