1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine

C14H22N2O — CID 82159159

IUPAC1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine
SMILESCOc1ccccc1CCN1CCCC(N)C1
InChIInChI=1S/C14H22N2O/c1-17-14-7-3-2-5-12(14)8-10-16-9-4-6-13(15)11-16/h2-3,5,7,13H,4,6,8-11,15H2,1H3
InChIKeyDISHLLBZEMOURI-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.66
Rot. Bonds4

About 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine

1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine (PubChem CID 82159159) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine.

Molecular Properties

Compound Name1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine
PubChem CID82159159
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine
SMILESCOc1ccccc1CCN1CCCC(N)C1
InChIInChI=1S/C14H22N2O/c1-17-14-7-3-2-5-12(14)8-10-16-9-4-6-13(15)11-16/h2-3,5,7,13H,4,6,8-11,15H2,1H3
InChIKeyDISHLLBZEMOURI-UHFFFAOYSA-N
XLogP1.66
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-methoxyphenoxy)ethyl]piperidin-3-amine;hydrochloride
CID 119910302
N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl-methylsulfamoyl]-N-methylethanamine
CID 97282112
1-[2-(4-methoxyphenyl)ethyl]piperidin-3-amine
CID 61296672
1-[2-(2-methoxyphenyl)ethyl]-4-methyl-1,5-diazocane
CID 106261953
N'-[[(3S)-1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N,N,N'-trimethylbutanediamide
CID 42287360
N'-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N,N,N'-trimethylbutanediamide
CID 23723725
1-[2-(2-methoxyphenyl)ethyl]-2-methylpyrrolidine
CID 75030496
3-(bromomethyl)-1-[(2-methoxyphenyl)methyl]piperidine
CID 80680227
1-[2-(2-methoxyphenyl)ethyl]piperidin-3-one
CID 83824146
1-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-1-methyl-3-phenylurea
CID 26391346
[2-[2-[3-(methoxymethyl)piperidin-1-yl]ethyl]phenyl]methanamine
CID 106587342
2-acetamido-N-[[(3R)-1-[2-(2-methoxyphenyl)ethyl]piperidin-3-yl]methyl]-N-methylacetamide
CID 25364961

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine?
The IUPAC name of 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine (CID 82159159) is 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine.
What is the SMILES notation for 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine?
The canonical SMILES for 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine is COc1ccccc1CCN1CCCC(N)C1.
What is the InChIKey of 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine?
The InChIKey is DISHLLBZEMOURI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-17-14-7-3-2-5-12(14)8-10-16-9-4-6-13(15)11-16/h2-3,5,7,13H,4,6,8-11,15H2,1H3.
What are the key properties of 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine?
1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine has a molecular weight of 234.34 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenyl)ethyl]piperidin-3-amine is sourced from PubChem (CID 82159159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).