N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine

C15H24N2O — CID 113218952

IUPACN-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine
SMILESCOc1ccccc1CCNC1CCN(C)CC1
InChIInChI=1S/C15H24N2O/c1-17-11-8-14(9-12-17)16-10-7-13-5-3-4-6-15(13)18-2/h3-6,14,16H,7-12H2,1-2H3
InChIKeyYQGPRRHBGYJSQE-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.92
Rot. Bonds5

About N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine

N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine (PubChem CID 113218952) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine
PubChem CID113218952
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine
SMILESCOc1ccccc1CCNC1CCN(C)CC1
InChIInChI=1S/C15H24N2O/c1-17-11-8-14(9-12-17)16-10-7-13-5-3-4-6-15(13)18-2/h3-6,14,16H,7-12H2,1-2H3
InChIKeyYQGPRRHBGYJSQE-UHFFFAOYSA-N
XLogP1.92
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 ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[2-(2-methoxyphenyl)ethylamino]piperidin-1-yl]ethanone
CID 23768743
1-benzyl-N-[2-(2-methoxyphenyl)ethyl]piperidin-4-amine
CID 27267411
N-[2-(2-methoxyphenyl)ethyl]-1-propan-2-ylpyrrolidin-3-amine
CID 103748166
N-[2-(2-chlorophenyl)ethyl]-1-methylpiperidin-4-amine
CID 23931096
4-tert-butyl-N-[2-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 783786
N-[2-(2-methoxyphenyl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 103847588
N-[3-(2-methoxyphenyl)propyl]-1-propan-2-ylpiperidin-4-amine
CID 50981884
3-N-[2-(2-methoxyphenyl)ethyl]cyclopentane-1,3-diamine
CID 114165383
N-[2-(2-methoxyphenyl)ethyl]thian-3-amine
CID 103885574
1-ethyl-3-[2-(2-methoxyphenyl)ethyl]-2-[2-(1-methylpiperidin-4-yl)ethyl]guanidine;hydroiodide
CID 111340926
ethyl 4-[[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]amino]piperidine-1-carboxylate
CID 109025237
2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106261295

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine (CID 113218952) is N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine is COc1ccccc1CCNC1CCN(C)CC1.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine?
The InChIKey is YQGPRRHBGYJSQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17-11-8-14(9-12-17)16-10-7-13-5-3-4-6-15(13)18-2/h3-6,14,16H,7-12H2,1-2H3.
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine?
N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine is sourced from PubChem (CID 113218952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).