3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine

C15H25N3O2 — CID 103225441

IUPAC3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine
SMILESCOCC(CN)N1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C15H25N3O2/c1-19-12-14(11-16)18-8-6-17(7-9-18)13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12,16H2,1-2H3
InChIKeyFOURNMLNMUTKED-UHFFFAOYSA-N
MW279.38 g/mol
LogP0.79
Rot. Bonds6

About 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine

3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine (PubChem CID 103225441) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine
PubChem CID103225441
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine
SMILESCOCC(CN)N1CCN(c2cccc(OC)c2)CC1
InChIInChI=1S/C15H25N3O2/c1-19-12-14(11-16)18-8-6-17(7-9-18)13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12,16H2,1-2H3
InChIKeyFOURNMLNMUTKED-UHFFFAOYSA-N
XLogP0.79
TPSA50.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-2-[4-(3-methylphenyl)piperazin-1-yl]propan-1-amine
CID 103225336
3-(3-methoxyphenoxy)-2-morpholin-4-ylpropan-1-amine
CID 112500977
(2S)-1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-2-amine
CID 28599641
2-[2-[4-(3-methoxyphenyl)piperazin-1-yl]ethoxy]ethanamine
CID 79479255
4-[4-(3-methoxyphenyl)piperazin-1-yl]pentan-2-one
CID 64696870
1-iodo-4-(3-methoxyphenyl)piperazine
CID 142256394
1-(3-methoxyphenyl)azepane
CID 57276431
N-ethyl-3-[4-(3-methoxyphenyl)piperazin-1-yl]butan-1-amine
CID 62418996
1-[(1S)-1-[1-(2-methoxyethyl)tetrazol-5-yl]-3-methylbutyl]-4-(3-methoxyphenyl)piperazine
CID 7098187
1-(3-methoxyphenyl)-4-(oxiran-2-ylmethyl)piperazine
CID 10243741
1-(3-methoxyphenyl)-4-[(3-methoxyphenyl)methyl]piperazine
CID 22199424
[4-(3-methoxyphenyl)piperazin-1-yl]methanesulfinate
CID 174627257

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine?
The IUPAC name of 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine (CID 103225441) is 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine.
What is the SMILES notation for 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine?
The canonical SMILES for 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine is COCC(CN)N1CCN(c2cccc(OC)c2)CC1.
What is the InChIKey of 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine?
The InChIKey is FOURNMLNMUTKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-19-12-14(11-16)18-8-6-17(7-9-18)13-4-3-5-15(10-13)20-2/h3-5,10,14H,6-9,11-12,16H2,1-2H3.
What are the key properties of 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine?
3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine has a molecular weight of 279.38 g/mol, XLogP of 0.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-[4-(3-methoxyphenyl)piperazin-1-yl]propan-1-amine is sourced from PubChem (CID 103225441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).