ethane;2-(2-methoxyethyl)piperazine;propane

C12H30N2O — CID 143332825

IUPACethane;2-(2-methoxyethyl)piperazine;propane
SMILESCC.CCC.COCCC1CNCCN1
InChIInChI=1S/C7H16N2O.C3H8.C2H6/c1-10-5-2-7-6-8-3-4-9-7;1-3-2;1-2/h7-9H,2-6H2,1H3;3H2,1-2H3;1-2H3
InChIKeyCNTNQZFVCSUIMT-UHFFFAOYSA-N
MW218.38 g/mol
LogP2.03
Rot. Bonds3

About ethane;2-(2-methoxyethyl)piperazine;propane

ethane;2-(2-methoxyethyl)piperazine;propane (PubChem CID 143332825) has the molecular formula C12H30N2O and a molecular weight of 218.38 g/mol. Its IUPAC name is ethane;2-(2-methoxyethyl)piperazine;propane.

Molecular Properties

Compound Nameethane;2-(2-methoxyethyl)piperazine;propane
PubChem CID143332825
Molecular FormulaC12H30N2O
Molecular Weight218.38 g/mol
Exact Mass218.24
IUPAC Nameethane;2-(2-methoxyethyl)piperazine;propane
SMILESCC.CCC.COCCC1CNCCN1
InChIInChI=1S/C7H16N2O.C3H8.C2H6/c1-10-5-2-7-6-8-3-4-9-7;1-3-2;1-2/h7-9H,2-6H2,1H3;3H2,1-2H3;1-2H3
InChIKeyCNTNQZFVCSUIMT-UHFFFAOYSA-N
XLogP2.03
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.38
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2-methoxyethyl)piperazine;dihydrochloride
CID 86346384
(2R)-2-butylpiperazine
CID 11182666
(2R)-2-(methoxymethyl)piperazine;dihydrochloride
CID 146013224
2-(methoxymethyl)piperazine;dihydrochloride
CID 66941255
(2R)-2-(2-bromoethyl)piperazine
CID 69174498
2-octadecylpiperazine
CID 155671137
N-ethyl-N-(piperazin-2-ylmethyl)ethanamine
CID 53437694
ethane;2-methylpiperazine;propane
CID 171563379
2-(2-methoxypropyl)piperazine
CID 53405896
triethoxy(piperazin-2-ylmethyl)silane
CID 174106836
3-[(2S)-piperazin-2-yl]propanoic acid
CID 86334249
(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol
CID 143593756

Frequently Asked Questions

What is the IUPAC name of ethane;2-(2-methoxyethyl)piperazine;propane?
The IUPAC name of ethane;2-(2-methoxyethyl)piperazine;propane (CID 143332825) is ethane;2-(2-methoxyethyl)piperazine;propane.
What is the SMILES notation for ethane;2-(2-methoxyethyl)piperazine;propane?
The canonical SMILES for ethane;2-(2-methoxyethyl)piperazine;propane is CC.CCC.COCCC1CNCCN1.
What is the InChIKey of ethane;2-(2-methoxyethyl)piperazine;propane?
The InChIKey is CNTNQZFVCSUIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O.C3H8.C2H6/c1-10-5-2-7-6-8-3-4-9-7;1-3-2;1-2/h7-9H,2-6H2,1H3;3H2,1-2H3;1-2H3.
What are the key properties of ethane;2-(2-methoxyethyl)piperazine;propane?
ethane;2-(2-methoxyethyl)piperazine;propane has a molecular weight of 218.38 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(2-methoxyethyl)piperazine;propane is sourced from PubChem (CID 143332825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).