2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine

C18H30N2O — CID 63160864

IUPAC2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine
SMILESCCC1(CC)CCN(CC(N)c2ccccc2OC)CC1
InChIInChI=1S/C18H30N2O/c1-4-18(5-2)10-12-20(13-11-18)14-16(19)15-8-6-7-9-17(15)21-3/h6-9,16H,4-5,10-14,19H2,1-3H3
InChIKeyZWRPPAIWTHEPIR-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.60
Rot. Bonds6

About 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine

2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine (PubChem CID 63160864) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine
PubChem CID63160864
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine
SMILESCCC1(CC)CCN(CC(N)c2ccccc2OC)CC1
InChIInChI=1S/C18H30N2O/c1-4-18(5-2)10-12-20(13-11-18)14-16(19)15-8-6-7-9-17(15)21-3/h6-9,16H,4-5,10-14,19H2,1-3H3
InChIKeyZWRPPAIWTHEPIR-UHFFFAOYSA-N
XLogP3.60
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
CID 103495074
2-(4,4-diethylpiperidin-1-yl)-1-(4-ethylphenyl)ethanamine
CID 63467884
1-(4,4-diethylpiperidin-1-yl)-3-phenylpropan-2-amine
CID 63161280
1-(2-methoxyphenyl)-2-(3-methoxypiperidin-1-yl)ethanamine
CID 102965644
(1R)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride
CID 53484779
1-[2-amino-2-(2-methoxyphenyl)ethyl]pyrrolidine-2,5-dione
CID 16781666
3-ethyl-1-(2-methoxyphenyl)pentan-1-amine
CID 82919557
2-(3,3-diethylpyrrolidin-1-yl)-1-(2,5-difluorophenyl)ethanamine
CID 107521756
1-(2-ethoxyphenyl)-2-(1,4-oxazepan-4-yl)ethanamine
CID 62988321
1-[2-(difluoromethoxy)phenyl]-2-(4-methylpiperazin-1-yl)ethanamine
CID 16780971
1-(4-ethyl-4-methylpiperidin-1-yl)-1-(2-methoxyphenyl)propan-2-amine
CID 63156671
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine?
The IUPAC name of 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine (CID 63160864) is 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine is CCC1(CC)CCN(CC(N)c2ccccc2OC)CC1.
What is the InChIKey of 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine?
The InChIKey is ZWRPPAIWTHEPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-18(5-2)10-12-20(13-11-18)14-16(19)15-8-6-7-9-17(15)21-3/h6-9,16H,4-5,10-14,19H2,1-3H3.
What are the key properties of 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine?
2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine has a molecular weight of 290.45 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethylpiperidin-1-yl)-1-(2-methoxyphenyl)ethanamine is sourced from PubChem (CID 63160864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).