2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide

C15H24N2O3 — CID 60676693

IUPAC2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)NCCOc1ccccc1OC
InChIInChI=1S/C15H24N2O3/c1-4-9-17-15(18)12(2)16-10-11-20-14-8-6-5-7-13(14)19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18)
InChIKeyZYMILAKQYWWMLC-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.58
Rot. Bonds9

About 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide

2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide (PubChem CID 60676693) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide
PubChem CID60676693
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)NCCOc1ccccc1OC
InChIInChI=1S/C15H24N2O3/c1-4-9-17-15(18)12(2)16-10-11-20-14-8-6-5-7-13(14)19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18)
InChIKeyZYMILAKQYWWMLC-UHFFFAOYSA-N
XLogP1.58
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-methoxyphenoxy)ethyl]-2-methylpropanamide
CID 113099759
2-(3-phenoxypropylamino)-N-propylpropanamide
CID 60695598
2-[2-(3,4-dimethoxyphenyl)ethylamino]-N-propylpropanamide
CID 43087369
N-pentyl-2-(2-phenoxyethylamino)propanamide
CID 60720089
1-methoxy-N-[2-(2-methoxyphenoxy)ethyl]propan-2-amine
CID 62572002
ethyl 4-(2-methoxyphenoxy)-2-(propylamino)butanoate
CID 63041590
N-[2-(2-methoxyphenoxy)ethyl]-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide
CID 51161276
2-(3,4-dimethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]propanamide
CID 133211025
4-butoxy-3-methoxy-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 46655429
(2R)-N-butyl-2-(2-methoxyphenoxy)propanamide
CID 40745436
1-[2-(2-methoxyphenoxy)ethyl]-3-(2-methoxyphenyl)urea
CID 17171255
2-(2-ethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]acetamide
CID 44669949

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide?
The IUPAC name of 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide (CID 60676693) is 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide.
What is the SMILES notation for 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide?
The canonical SMILES for 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide is CCCNC(=O)C(C)NCCOc1ccccc1OC.
What is the InChIKey of 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide?
The InChIKey is ZYMILAKQYWWMLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-4-9-17-15(18)12(2)16-10-11-20-14-8-6-5-7-13(14)19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18).
What are the key properties of 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide?
2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide has a molecular weight of 280.37 g/mol, XLogP of 1.58, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyphenoxy)ethylamino]-N-propylpropanamide is sourced from PubChem (CID 60676693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).