2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide

C17H20N2O2 — CID 61028416

IUPAC2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CN(C)C(=O)COc1ccc(N)cc1
InChIInChI=1S/C17H20N2O2/c1-13-5-3-4-6-14(13)11-19(2)17(20)12-21-16-9-7-15(18)8-10-16/h3-10H,11-12,18H2,1-2H3
InChIKeyIAZQYFSHMLDENO-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.61
Rot. Bonds5

About 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide

2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide (PubChem CID 61028416) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
PubChem CID61028416
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CN(C)C(=O)COc1ccc(N)cc1
InChIInChI=1S/C17H20N2O2/c1-13-5-3-4-6-14(13)11-19(2)17(20)12-21-16-9-7-15(18)8-10-16/h3-10H,11-12,18H2,1-2H3
InChIKeyIAZQYFSHMLDENO-UHFFFAOYSA-N
XLogP2.61
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-[(2-methylphenyl)methyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 36621925
[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843353
2-(2-bromophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 112777998
N-methyl-N-[(2-methylphenyl)methyl]-2-[4-[methyl(thiophen-2-ylsulfonyl)amino]phenoxy]acetamide
CID 31237396
2-(4-aminophenoxy)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 10085503
2-(5-amino-2-pyridinyl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide;hydrochloride
CID 120617349
2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 16769161
2-[4-(5-butyl-1,2,4-oxadiazol-3-yl)phenoxy]-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 60585503
[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl] 3,5-dimethoxybenzoate
CID 7727298
4-(4-acetylphenoxy)-N-methyl-N-[(2-methylphenyl)methyl]butanamide
CID 78781704
2-(2-chloro-5-methylphenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide
CID 112775470
2-(4-aminophenoxy)-N-(2-methoxyethyl)-N-methylacetamide
CID 61126914

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide (CID 61028416) is 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide is Cc1ccccc1CN(C)C(=O)COc1ccc(N)cc1.
What is the InChIKey of 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
The InChIKey is IAZQYFSHMLDENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13-5-3-4-6-14(13)11-19(2)17(20)12-21-16-9-7-15(18)8-10-16/h3-10H,11-12,18H2,1-2H3.
What are the key properties of 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide?
2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenoxy)-N-methyl-N-[(2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 61028416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).