N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide

C16H18N2O2 — CID 39369561

IUPACN-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide
SMILESNc1cccc(OCCNC(=O)Cc2ccccc2)c1
InChIInChI=1S/C16H18N2O2/c17-14-7-4-8-15(12-14)20-10-9-18-16(19)11-13-5-2-1-3-6-13/h1-8,12H,9-11,17H2,(H,18,19)
InChIKeyUMCZWDGJMMUVAQ-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.01
Rot. Bonds6

About N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide

N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide (PubChem CID 39369561) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide
PubChem CID39369561
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide
SMILESNc1cccc(OCCNC(=O)Cc2ccccc2)c1
InChIInChI=1S/C16H18N2O2/c17-14-7-4-8-15(12-14)20-10-9-18-16(19)11-13-5-2-1-3-6-13/h1-8,12H,9-11,17H2,(H,18,19)
InChIKeyUMCZWDGJMMUVAQ-UHFFFAOYSA-N
XLogP2.01
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(3-aminophenoxy)ethyl]-3-phenylpropanamide
CID 39384701
2-(3-aminophenyl)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 62499528
N-[2-(3-fluorophenoxy)ethyl]-2-phenylacetamide
CID 110483020
N-[2-(3-aminophenoxy)ethyl]-3-pyridin-3-ylpropanamide
CID 114289960
3-(3-aminophenoxy)-N-(3-methoxypropyl)propanamide
CID 61095538
N-[2-(3-aminophenoxy)ethyl]-4-hydroxybenzamide
CID 61031492
N-[2-(3-aminophenoxy)ethyl]-3,5-dihydroxybenzamide
CID 107702195
N-[2-(3-methylphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 113099136
2-(3-aminophenoxy)-N-(3-methoxypropyl)acetamide
CID 61036344
N-[2-(3-aminophenoxy)ethyl]cyclopropanecarboxamide
CID 39244343
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methoxyphenyl)acetamide
CID 46399940
3-amino-N-(3-phenoxypropyl)benzamide
CID 62074463

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide (CID 39369561) is N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide is Nc1cccc(OCCNC(=O)Cc2ccccc2)c1.
What is the InChIKey of N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide?
The InChIKey is UMCZWDGJMMUVAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c17-14-7-4-8-15(12-14)20-10-9-18-16(19)11-13-5-2-1-3-6-13/h1-8,12H,9-11,17H2,(H,18,19).
What are the key properties of N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide?
N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide has a molecular weight of 270.33 g/mol, XLogP of 2.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-aminophenoxy)ethyl]-2-phenylacetamide is sourced from PubChem (CID 39369561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).