ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine

C15H34N4 — CID 170586549

IUPACethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
SMILESCC.CCN1CCN(CCN2CCN(C)CC2)CC1
InChIInChI=1S/C13H28N4.C2H6/c1-3-15-8-10-17(11-9-15)13-12-16-6-4-14(2)5-7-16;1-2/h3-13H2,1-2H3;1-2H3
InChIKeySNBGBJIOPVQZDX-UHFFFAOYSA-N
MW270.46 g/mol
LogP0.90
Rot. Bonds4

About ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine

ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine (PubChem CID 170586549) has the molecular formula C15H34N4 and a molecular weight of 270.46 g/mol. Its IUPAC name is ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine.

Molecular Properties

Compound Nameethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
PubChem CID170586549
Molecular FormulaC15H34N4
Molecular Weight270.46 g/mol
Exact Mass270.28
IUPAC Nameethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
SMILESCC.CCN1CCN(CCN2CCN(C)CC2)CC1
InChIInChI=1S/C13H28N4.C2H6/c1-3-15-8-10-17(11-9-15)13-12-16-6-4-14(2)5-7-16;1-2/h3-13H2,1-2H3;1-2H3
InChIKeySNBGBJIOPVQZDX-UHFFFAOYSA-N
XLogP0.90
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 82084531
1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
CID 160568928
ethane;1-ethyl-4-methylpiperazine;methanethiol
CID 142272147
butane;1-ethyl-4-methylpiperazine
CID 143179774
1,4,7-trimethyl-10-[2-(4,7,10-trimethyl-1,4,7,10-tetrazacyclododec-1-yl)ethyl]-1,4,7,10-tetrazacyclododecane
CID 21130153
acetaldehyde;1-ethyl-4-methylpiperazine
CID 143528036
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-ethyl-3-methylimidazolidine;phosphane;bromide
CID 167699735
ethane;1-[(1-ethylpiperidin-4-yl)methyl]-4-methylpiperazine
CID 163403762
1-ethyl-4,7-dimethyl-10-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane
CID 118545612
1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
CID 165044772
1,4-diethylpiperazine;sulfane
CID 177062456

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine?
The IUPAC name of ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine (CID 170586549) is ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine.
What is the SMILES notation for ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine?
The canonical SMILES for ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine is CC.CCN1CCN(CCN2CCN(C)CC2)CC1.
What is the InChIKey of ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine?
The InChIKey is SNBGBJIOPVQZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4.C2H6/c1-3-15-8-10-17(11-9-15)13-12-16-6-4-14(2)5-7-16;1-2/h3-13H2,1-2H3;1-2H3.
What are the key properties of ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine?
ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine has a molecular weight of 270.46 g/mol, XLogP of 0.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine is sourced from PubChem (CID 170586549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).