2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide

C14H19N3O3 — CID 43572560

IUPAC2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)COc1ccccc1N
InChIInChI=1S/C14H19N3O3/c1-17(8-13(18)16-10-6-7-10)14(19)9-20-12-5-3-2-4-11(12)15/h2-5,10H,6-9,15H2,1H3,(H,16,18)
InChIKeyCUYLMILDXQOFLI-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.38
Rot. Bonds6

About 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide

2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide (PubChem CID 43572560) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
PubChem CID43572560
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)C(=O)COc1ccccc1N
InChIInChI=1S/C14H19N3O3/c1-17(8-13(18)16-10-6-7-10)14(19)9-20-12-5-3-2-4-11(12)15/h2-5,10H,6-9,15H2,1H3,(H,16,18)
InChIKeyCUYLMILDXQOFLI-UHFFFAOYSA-N
XLogP0.38
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-(2-cyanophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
CID 60665697
2-[3-(2-aminophenoxy)propyl-methylamino]-N-cyclopropylacetamide
CID 43574806
[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-ethoxybenzoate
CID 9417725
3-[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethoxy]thiophene-2-carboxylic acid
CID 63338225
2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N,N-diethylacetamide
CID 61108210
2-[[2-(4-acetyl-2-methoxyphenoxy)acetyl]-methylamino]-N-cyclopropylacetamide
CID 18093332
3-(2-aminophenoxy)-N-cyclohexylpropanamide
CID 54915855
2-(2-aminophenoxy)-N-[2-(dimethylamino)ethyl]-N-methylacetamide
CID 63693890
[2-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] naphthalene-2-carboxylate
CID 9416612
N-cyclopropyl-2-[methyl-[2-(4-nitrophenoxy)acetyl]amino]acetamide
CID 27015551
3-(3-aminophenoxy)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpropanamide
CID 61093289
ethyl 2-[[2-(2-aminophenoxy)acetyl]-cyclopropylamino]acetate
CID 61114031

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide (CID 43572560) is 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)C(=O)COc1ccccc1N.
What is the InChIKey of 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide?
The InChIKey is CUYLMILDXQOFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-17(8-13(18)16-10-6-7-10)14(19)9-20-12-5-3-2-4-11(12)15/h2-5,10H,6-9,15H2,1H3,(H,16,18).
What are the key properties of 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide?
2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide has a molecular weight of 277.32 g/mol, XLogP of 0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-aminophenoxy)acetyl]-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 43572560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).