N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine

C13H28N4 — CID 158831643

IUPACN,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine
SMILESCN(C)CCN1CCNCC1N1CCCCC1
InChIInChI=1S/C13H28N4/c1-15(2)10-11-17-9-6-14-12-13(17)16-7-4-3-5-8-16/h13-14H,3-12H2,1-2H3
InChIKeyAKSOVBBYCORZFD-UHFFFAOYSA-N
MW240.39 g/mol
LogP0.27
Rot. Bonds4

About N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine

N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine (PubChem CID 158831643) has the molecular formula C13H28N4 and a molecular weight of 240.39 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine
PubChem CID158831643
Molecular FormulaC13H28N4
Molecular Weight240.39 g/mol
Exact Mass240.23
IUPAC NameN,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine
SMILESCN(C)CCN1CCNCC1N1CCCCC1
InChIInChI=1S/C13H28N4/c1-15(2)10-11-17-9-6-14-12-13(17)16-7-4-3-5-8-16/h13-14H,3-12H2,1-2H3
InChIKeyAKSOVBBYCORZFD-UHFFFAOYSA-N
XLogP0.27
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(methoxymethyl)piperazin-1-yl]-N,N-dimethylethanamine
CID 117003769
1-[3-(azepan-1-yl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 82564930
2-(1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyrazin-4-yl)-N,N-dimethylethanamine
CID 102571338
(2R)-2-methyl-1-(2-piperidin-1-ylethyl)piperazine
CID 82761100
(2S)-2-methyl-1-(2-piperidin-1-ylethyl)piperazine
CID 82755408
1-(2-pyrrolidin-1-ylpiperazin-1-yl)ethanone
CID 70297002
2-[3-(1,4-diazepan-1-yl)pyrrolidin-1-yl]-N,N-dimethylethanamine
CID 117004539
N,N-diethyl-2-[(2R)-2-methylpiperazin-1-yl]ethanamine
CID 82760939
2-[1-[1-(2-hydroxyethyl)piperazin-2-yl]piperidin-2-yl]ethanol;piperazine
CID 174426773
1-(1-ethylpiperidin-2-yl)-1,4-diazepane
CID 115100694
2-[4-[2-(1,4-diazepan-1-yl)ethyl]piperazin-1-yl]-N,N-dimethylethanamine
CID 62887962
1-[1-[2-(dimethylamino)ethyl]azepan-2-yl]propan-2-ol
CID 114338880

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine (CID 158831643) is N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine is CN(C)CCN1CCNCC1N1CCCCC1.
What is the InChIKey of N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine?
The InChIKey is AKSOVBBYCORZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4/c1-15(2)10-11-17-9-6-14-12-13(17)16-7-4-3-5-8-16/h13-14H,3-12H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine?
N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine has a molecular weight of 240.39 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-piperidin-1-ylpiperazin-1-yl)ethanamine is sourced from PubChem (CID 158831643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).