3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide

C13H20N2O3 — CID 61269487

IUPAC3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide
SMILESCOc1ccc(CC(C)N)c(OCCC(N)=O)c1
InChIInChI=1S/C13H20N2O3/c1-9(14)7-10-3-4-11(17-2)8-12(10)18-6-5-13(15)16/h3-4,8-9H,5-7,14H2,1-2H3,(H2,15,16)
InChIKeyQSYKEJKHOXTJPL-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.84
Rot. Bonds7

About 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide

3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide (PubChem CID 61269487) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide.

Molecular Properties

Compound Name3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide
PubChem CID61269487
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide
SMILESCOc1ccc(CC(C)N)c(OCCC(N)=O)c1
InChIInChI=1S/C13H20N2O3/c1-9(14)7-10-3-4-11(17-2)8-12(10)18-6-5-13(15)16/h3-4,8-9H,5-7,14H2,1-2H3,(H2,15,16)
InChIKeyQSYKEJKHOXTJPL-UHFFFAOYSA-N
XLogP0.84
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide 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

1-[4-methoxy-2-[3-(2-methoxyethoxy)propoxy]phenyl]propan-2-amine
CID 103411540
1-[4-methoxy-2-(2-propan-2-ylsulfonylethoxy)phenyl]propan-2-amine
CID 106728377
1-(2-but-3-ynoxy-4-methoxyphenyl)propan-2-amine
CID 61269126
2-(3-amino-3-oxopropoxy)-4-methoxybenzoic acid
CID 60712906
3-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-ethylpropanamide
CID 62325762
3-(2-formyl-5-methoxyphenoxy)propanamide
CID 61268492
1-[2-(2-methoxyethoxy)-4-propoxyphenyl]propan-2-amine
CID 60906244
3-[4-(2-aminopropyl)-2-methoxyphenoxy]propanamide
CID 60906561
1-[2-(3-chloroprop-2-enoxy)-4-methoxyphenyl]propan-2-amine
CID 61269127
1-(2-butoxy-4-propoxyphenyl)propan-2-amine
CID 54930871
1-(2-butan-2-yloxy-4-methoxyphenyl)propan-2-amine
CID 61269298
methyl 2-[2-(2-aminopropyl)-4-methoxyphenoxy]acetate
CID 54930741

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide?
The IUPAC name of 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide (CID 61269487) is 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide.
What is the SMILES notation for 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide?
The canonical SMILES for 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide is COc1ccc(CC(C)N)c(OCCC(N)=O)c1.
What is the InChIKey of 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide?
The InChIKey is QSYKEJKHOXTJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-9(14)7-10-3-4-11(17-2)8-12(10)18-6-5-13(15)16/h3-4,8-9H,5-7,14H2,1-2H3,(H2,15,16).
What are the key properties of 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide?
3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide has a molecular weight of 252.31 g/mol, XLogP of 0.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-aminopropyl)-5-methoxyphenoxy]propanamide is sourced from PubChem (CID 61269487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).