2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine

C15H24N2O — CID 102965612

IUPAC2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine
SMILESCNC(CN1CCCC(OC)C1)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-16-15(13-7-4-3-5-8-13)12-17-10-6-9-14(11-17)18-2/h3-5,7-8,14-16H,6,9-12H2,1-2H3
InChIKeyPQAUNPUGBTYOFJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.06
Rot. Bonds5

About 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine

2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine (PubChem CID 102965612) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine.

Molecular Properties

Compound Name2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine
PubChem CID102965612
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine
SMILESCNC(CN1CCCC(OC)C1)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-16-15(13-7-4-3-5-8-13)12-17-10-6-9-14(11-17)18-2/h3-5,7-8,14-16H,6,9-12H2,1-2H3
InChIKeyPQAUNPUGBTYOFJ-UHFFFAOYSA-N
XLogP2.06
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3S)-3-methoxypyrrolidin-1-yl]-N-methyl-1-phenylethanamine
CID 135374431
methyl 3-(3-methoxypiperidin-1-yl)-2-phenylpropanoate
CID 102959585
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-methyl-1-phenylethanamine
CID 63150172
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 103532164
N-ethyl-1-(3-methoxyphenyl)-2-(3-methoxypiperidin-1-yl)ethanamine
CID 102965538
1-(3-bromophenyl)-3-(3-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 102967425
N,N-dimethyl-1-[2-(methylamino)-2-phenylethyl]pyrrolidin-3-amine
CID 63164036
(3S)-1-[(2S)-2-(methylamino)-2-phenylethyl]pyrrolidin-3-ol;dihydrochloride
CID 23594216
1-(2-ethoxyphenyl)-2-(3-methoxypyrrolidin-1-yl)-N-methylethanamine
CID 103532336
1-(2-fluorophenyl)-3-(3-methoxypiperidin-1-yl)-N,2-dimethylpropan-1-amine
CID 102967344
1-(2-methoxyphenyl)-2-(3-methoxypiperidin-1-yl)ethanamine
CID 102965644
1-(3,5-dimethylphenyl)-N-ethyl-2-(3-methoxypiperidin-1-yl)ethanamine
CID 102965565

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine?
The IUPAC name of 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine (CID 102965612) is 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine.
What is the SMILES notation for 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine?
The canonical SMILES for 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine is CNC(CN1CCCC(OC)C1)c1ccccc1.
What is the InChIKey of 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine?
The InChIKey is PQAUNPUGBTYOFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-15(13-7-4-3-5-8-13)12-17-10-6-9-14(11-17)18-2/h3-5,7-8,14-16H,6,9-12H2,1-2H3.
What are the key properties of 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine?
2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine is sourced from PubChem (CID 102965612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).