ethane;1-methoxypiperazine

C7H18N2O — CID 142806936

IUPACethane;1-methoxypiperazine
SMILESCC.CON1CCNCC1
InChIInChI=1S/C5H12N2O.C2H6/c1-8-7-4-2-6-3-5-7;1-2/h6H,2-5H2,1H3;1-2H3
InChIKeyHNMZBARHGFCTPP-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.48
Rot. Bonds1

About ethane;1-methoxypiperazine

ethane;1-methoxypiperazine (PubChem CID 142806936) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is ethane;1-methoxypiperazine.

Molecular Properties

Compound Nameethane;1-methoxypiperazine
PubChem CID142806936
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Nameethane;1-methoxypiperazine
SMILESCC.CON1CCNCC1
InChIInChI=1S/C5H12N2O.C2H6/c1-8-7-4-2-6-3-5-7;1-2/h6H,2-5H2,1H3;1-2H3
InChIKeyHNMZBARHGFCTPP-UHFFFAOYSA-N
XLogP0.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methane;1-methoxypiperazine
CID 142233800
methane;1-methoxypiperazine
CID 157354149
1-piperazin-1-yloxypiperazine;dihydrochloride
CID 174358981
dimethyl piperazin-1-yl phosphate
CID 175316029
1-methoxypiperidine
CID 19831385
ethane;1-methylpiperazine
CID 91350928
(5S,6R)-6-(7-methoxy-1,4,7,10-tetrazacyclododec-1-yl)-2,2-dimethyl-1,3-dioxepan-5-ol
CID 159148624
N-piperazin-1-yloxyethanimine
CID 175552933
piperazin-1-yl acetate
CID 54492305
ethane;methane;1-methylpiperazine
CID 142051303
5-methoxy-1,2-dimethyl-1,2,5-triazepane
CID 90180666
dipiperazin-1-yl oxalate
CID 57296724

Frequently Asked Questions

What is the IUPAC name of ethane;1-methoxypiperazine?
The IUPAC name of ethane;1-methoxypiperazine (CID 142806936) is ethane;1-methoxypiperazine.
What is the SMILES notation for ethane;1-methoxypiperazine?
The canonical SMILES for ethane;1-methoxypiperazine is CC.CON1CCNCC1.
What is the InChIKey of ethane;1-methoxypiperazine?
The InChIKey is HNMZBARHGFCTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O.C2H6/c1-8-7-4-2-6-3-5-7;1-2/h6H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;1-methoxypiperazine?
ethane;1-methoxypiperazine has a molecular weight of 146.23 g/mol, XLogP of 0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methoxypiperazine is sourced from PubChem (CID 142806936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).