2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide

C16H19N3O2 — CID 61115292

IUPAC2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
SMILESCCN(Cc1ccncc1)C(=O)COc1cccc(N)c1
InChIInChI=1S/C16H19N3O2/c1-2-19(11-13-6-8-18-9-7-13)16(20)12-21-15-5-3-4-14(17)10-15/h3-10H,2,11-12,17H2,1H3
InChIKeyRZFDPMVADHPHIS-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.09
Rot. Bonds6

About 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide

2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 61115292) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
PubChem CID61115292
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
SMILESCCN(Cc1ccncc1)C(=O)COc1cccc(N)c1
InChIInChI=1S/C16H19N3O2/c1-2-19(11-13-6-8-18-9-7-13)16(20)12-21-15-5-3-4-14(17)10-15/h3-10H,2,11-12,17H2,1H3
InChIKeyRZFDPMVADHPHIS-UHFFFAOYSA-N
XLogP2.09
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzyl-2-(3-ethoxyphenoxy)-N-ethylacetamide
CID 112977716
3-(3-aminophenoxy)-N-methyl-N-(pyridin-4-ylmethyl)propanamide
CID 61095622
3-amino-N-ethyl-N-(pyridin-4-ylmethyl)benzamide
CID 54905832
3-ethoxy-N-ethyl-N-(pyridin-4-ylmethyl)benzamide
CID 6466465
N-[(3-aminophenyl)methyl]-N-ethylpyridine-4-carboxamide
CID 43459023
N-benzyl-2-(3-cyanophenoxy)-N-ethylacetamide
CID 7964477
2-(3-aminophenoxy)-N-[1-(dimethylamino)propan-2-yl]-N-ethylacetamide
CID 103187365
N-ethyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 564270
2-(3-bromophenoxy)-N,N-diethylacetamide
CID 24689388
N-[(3-aminophenyl)methyl]-N-ethyl-3-fluoropyridine-4-carboxamide
CID 64948867
2-(3-acetamidophenoxy)-N,N-diethylacetamide
CID 7698145
2-(3-aminophenoxy)-N-methyl-N-pentan-2-ylacetamide
CID 61093481

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide (CID 61115292) is 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide is CCN(Cc1ccncc1)C(=O)COc1cccc(N)c1.
What is the InChIKey of 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is RZFDPMVADHPHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-2-19(11-13-6-8-18-9-7-13)16(20)12-21-15-5-3-4-14(17)10-15/h3-10H,2,11-12,17H2,1H3.
What are the key properties of 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide?
2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenoxy)-N-ethyl-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 61115292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).