3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine

C19H25NO3 — CID 23458367

IUPAC3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine
SMILESCCOc1ccccc1OC(c1ccccc1)C(CNC)OC
InChIInChI=1S/C19H25NO3/c1-4-22-16-12-8-9-13-17(16)23-19(18(21-3)14-20-2)15-10-6-5-7-11-15/h5-13,18-20H,4,14H2,1-3H3
InChIKeyXGACUQOULOCEJW-UHFFFAOYSA-N
MW315.41 g/mol
LogP3.44
Rot. Bonds9

About 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine

3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine (PubChem CID 23458367) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol. Its IUPAC name is 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine.

Molecular Properties

Compound Name3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine
PubChem CID23458367
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC Name3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine
SMILESCCOc1ccccc1OC(c1ccccc1)C(CNC)OC
InChIInChI=1S/C19H25NO3/c1-4-22-16-12-8-9-13-17(16)23-19(18(21-3)14-20-2)15-10-6-5-7-11-15/h5-13,18-20H,4,14H2,1-3H3
InChIKeyXGACUQOULOCEJW-UHFFFAOYSA-N
XLogP3.44
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-3-(2-methoxyphenoxy)-3-(2-methoxyphenyl)-N-methylpropan-1-amine
CID 23458355
(1S)-3-amino-1-(2-ethoxyphenoxy)-1-phenylpropan-2-ol
CID 70987584
2-[(1S,2S)-2-(2-ethoxyphenoxy)-1-methoxy-2-phenylethyl]-4,5-dihydro-1H-imidazole
CID 163084362
3-amino-1-(2-ethoxyphenoxy)-1-phenylpropan-2-ol;methanesulfonic acid
CID 46780268
1-(2-ethoxyphenyl)-2-methoxy-2-phenylethanol
CID 116757008
N-methyl-3-naphthalen-1-yloxy-3-phenyl-2-phenylmethoxypropan-1-amine
CID 69271191
(2R,3S)-N-methyl-3-naphthalen-1-yloxy-3-phenyl-2-phenylmethoxypropan-1-amine;hydrochloride
CID 10455572
3-(3H-1,2-benzodioxol-6-yloxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine
CID 23335297
3-(4-chlorophenyl)-2-methoxy-N-methyl-3-phenylpropan-1-amine
CID 141113717
(2R,3R)-2-fluoro-N-methyl-3-naphthalen-1-yloxy-3-phenylpropan-1-amine;hydrochloride
CID 69274127
2-(2-ethoxyphenoxy)propanoic acid
CID 16771653
2-(2-ethoxyphenoxy)-1-phenylethanol
CID 60730563

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine?
The IUPAC name of 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine (CID 23458367) is 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine.
What is the SMILES notation for 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine?
The canonical SMILES for 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine is CCOc1ccccc1OC(c1ccccc1)C(CNC)OC.
What is the InChIKey of 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine?
The InChIKey is XGACUQOULOCEJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO3/c1-4-22-16-12-8-9-13-17(16)23-19(18(21-3)14-20-2)15-10-6-5-7-11-15/h5-13,18-20H,4,14H2,1-3H3.
What are the key properties of 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine?
3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine has a molecular weight of 315.41 g/mol, XLogP of 3.44, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenoxy)-2-methoxy-N-methyl-3-phenylpropan-1-amine is sourced from PubChem (CID 23458367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).