N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide

C17H20N2O2 — CID 62388330

IUPACN-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NCCOc2ccc(N)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-13-3-2-4-14(11-13)12-17(20)19-9-10-21-16-7-5-15(18)6-8-16/h2-8,11H,9-10,12,18H2,1H3,(H,19,20)
InChIKeyDEDIAWNRJNFWAY-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.31
Rot. Bonds6

About N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide

N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide (PubChem CID 62388330) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide
PubChem CID62388330
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NCCOc2ccc(N)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-13-3-2-4-14(11-13)12-17(20)19-9-10-21-16-7-5-15(18)6-8-16/h2-8,11H,9-10,12,18H2,1H3,(H,19,20)
InChIKeyDEDIAWNRJNFWAY-UHFFFAOYSA-N
XLogP2.31
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-ethoxyphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 30350207
N-[2-(3-methylphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 113099136
2-(3-aminophenyl)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 62499528
N-[2-(3-ethylphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 113100017
N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
CID 40724453
N-[2-(4-aminophenoxy)ethyl]-3-(4-methylphenyl)propanamide
CID 84816880
2-(3-fluorophenyl)-N-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]acetamide
CID 46489994
N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide
CID 39369561
N-[2-(4-ethylphenoxy)ethyl]-2-(3-fluorophenyl)acetamide
CID 113100102
N-[2-(4-aminophenoxy)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112601847
N-[2-(2-methoxyethylamino)ethyl]-2-(3-methylphenyl)acetamide
CID 82994349
N-[2-(4-aminophenoxy)ethyl]-3,3-dimethylbutanamide
CID 54915240

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide (CID 62388330) is N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)NCCOc2ccc(N)cc2)c1.
What is the InChIKey of N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is DEDIAWNRJNFWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13-3-2-4-14(11-13)12-17(20)19-9-10-21-16-7-5-15(18)6-8-16/h2-8,11H,9-10,12,18H2,1H3,(H,19,20).
What are the key properties of N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide?
N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminophenoxy)ethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 62388330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).