N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide

C20H26N2O3 — CID 8791050

IUPACN-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
SMILESCOc1ccccc1OCCNC(=O)CN(C)Cc1ccccc1C
InChIInChI=1S/C20H26N2O3/c1-16-8-4-5-9-17(16)14-22(2)15-20(23)21-12-13-25-19-11-7-6-10-18(19)24-3/h4-11H,12-15H2,1-3H3,(H,21,23)
InChIKeyZAGUGICNDDPIBS-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.63
Rot. Bonds9

About N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide

N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide (PubChem CID 8791050) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
PubChem CID8791050
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
SMILESCOc1ccccc1OCCNC(=O)CN(C)Cc1ccccc1C
InChIInChI=1S/C20H26N2O3/c1-16-8-4-5-9-17(16)14-22(2)15-20(23)21-12-13-25-19-11-7-6-10-18(19)24-3/h4-11H,12-15H2,1-3H3,(H,21,23)
InChIKeyZAGUGICNDDPIBS-UHFFFAOYSA-N
XLogP2.63
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.63
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 N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The IUPAC name of N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide (CID 8791050) is N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide.
What is the SMILES notation for N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The canonical SMILES for N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide is COc1ccccc1OCCNC(=O)CN(C)Cc1ccccc1C.
What is the InChIKey of N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
The InChIKey is ZAGUGICNDDPIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-16-8-4-5-9-17(16)14-22(2)15-20(23)21-12-13-25-19-11-7-6-10-18(19)24-3/h4-11H,12-15H2,1-3H3,(H,21,23).
What are the key properties of N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide?
N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide has a molecular weight of 342.44 g/mol, XLogP of 2.63, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenoxy)ethyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide is sourced from PubChem (CID 8791050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).