1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine

C16H27NO3 — CID 107506757

IUPAC1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine
SMILESCCCNC(COC)COc1ccc(CCOC)cc1
InChIInChI=1S/C16H27NO3/c1-4-10-17-15(12-19-3)13-20-16-7-5-14(6-8-16)9-11-18-2/h5-8,15,17H,4,9-13H2,1-3H3
InChIKeyORZALOPUFHCSCT-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.27
Rot. Bonds11

About 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine

1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine (PubChem CID 107506757) has the molecular formula C16H27NO3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine
PubChem CID107506757
Molecular FormulaC16H27NO3
Molecular Weight281.40 g/mol
Exact Mass281.20
IUPAC Name1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine
SMILESCCCNC(COC)COc1ccc(CCOC)cc1
InChIInChI=1S/C16H27NO3/c1-4-10-17-15(12-19-3)13-20-16-7-5-14(6-8-16)9-11-18-2/h5-8,15,17H,4,9-13H2,1-3H3
InChIKeyORZALOPUFHCSCT-UHFFFAOYSA-N
XLogP2.27
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine 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-chlorophenoxy)-3-methoxy-N-propylpropan-2-amine
CID 105165730
1-[4-(2-methoxyethyl)phenoxy]-N-methylpentan-2-amine
CID 62044092
5-methoxy-1-phenoxy-N-propylpentan-2-amine
CID 112688298
3-[4-(2-methoxyethyl)phenoxy]-2-(methylamino)propan-1-ol
CID 64807086
N-ethyl-1-methoxy-3-(4-propoxyphenoxy)propan-2-amine
CID 107506697
4-[4-(2-methoxyethyl)phenoxy]-2-(propylamino)butanoic acid
CID 63033159
N-[2-[4-(2-methoxyethyl)phenoxy]ethyl]propan-2-amine
CID 14694037
1-methoxy-7-phenyl-N-propylheptan-4-amine
CID 65092055
(2S)-2-[[(2R)-2-hydroxy-3-[4-(2-methoxyethyl)phenoxy]propyl]amino]butan-1-ol
CID 25186198
N-ethyl-1-methoxy-3-(4-methylphenoxy)propan-2-amine
CID 107506620
4-[4-(2-hydroxyethyl)phenoxy]-2-(propylamino)butan-1-ol
CID 107710142
4-(4-propoxyphenoxy)-3-(propylamino)butan-1-ol
CID 64899515

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine?
The IUPAC name of 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine (CID 107506757) is 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine.
What is the SMILES notation for 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine?
The canonical SMILES for 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine is CCCNC(COC)COc1ccc(CCOC)cc1.
What is the InChIKey of 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine?
The InChIKey is ORZALOPUFHCSCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3/c1-4-10-17-15(12-19-3)13-20-16-7-5-14(6-8-16)9-11-18-2/h5-8,15,17H,4,9-13H2,1-3H3.
What are the key properties of 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine?
1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 2.27, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[4-(2-methoxyethyl)phenoxy]-N-propylpropan-2-amine is sourced from PubChem (CID 107506757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).