3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide

C14H20N2O3 — CID 82740805

IUPAC3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide
SMILESCN(C(=O)CCOc1ccccc1N)C1CCOC1
InChIInChI=1S/C14H20N2O3/c1-16(11-6-8-18-10-11)14(17)7-9-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3
InChIKeyKEQRVPRWJHYYIU-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.28
Rot. Bonds5

About 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide

3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide (PubChem CID 82740805) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide
PubChem CID82740805
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide
SMILESCN(C(=O)CCOc1ccccc1N)C1CCOC1
InChIInChI=1S/C14H20N2O3/c1-16(11-6-8-18-10-11)14(17)7-9-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3
InChIKeyKEQRVPRWJHYYIU-UHFFFAOYSA-N
XLogP1.28
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-aminophenoxy)ethyl]-N-methyloxolan-3-amine
CID 82732858
3-(2-aminophenoxy)-N-cyclopropyl-N-ethylpropanamide
CID 61095746
4-amino-N-methyl-N-(oxolan-3-yl)-4-phenylbutanamide
CID 81489574
2-amino-N-methyl-N-(oxolan-3-yl)benzamide;hydrochloride
CID 119945295
3-(3-aminophenyl)-N-methyl-N-(oxolan-3-yl)propanamide
CID 82740888
2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide
CID 80717573
4-amino-N,4-dimethyl-N-(oxolan-3-yl)pentanamide
CID 81489962
3-(2-aminophenoxy)-N-morpholin-4-ylpropanamide
CID 83013203
5-[methyl(oxolan-3-yl)amino]-5-oxopentanoic acid
CID 82732881
3-amino-N-methyl-N-(oxolan-3-yl)-3-sulfanylidenepropanamide
CID 82738625
2-[2-[methyl(oxolan-3-yl)amino]-2-oxoethyl]benzoic acid
CID 104601736
2-[3-[methyl(oxolan-3-yl)amino]propoxy]benzenecarbothioamide
CID 82737803

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide (CID 82740805) is 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide is CN(C(=O)CCOc1ccccc1N)C1CCOC1.
What is the InChIKey of 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide?
The InChIKey is KEQRVPRWJHYYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-16(11-6-8-18-10-11)14(17)7-9-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3.
What are the key properties of 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide?
3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide has a molecular weight of 264.32 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide is sourced from PubChem (CID 82740805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).