ethane;1,2,2,6,6-pentamethylpiperazine

C11H26N2 — CID 168918008

IUPACethane;1,2,2,6,6-pentamethylpiperazine
SMILESCC.CN1C(C)(C)CNCC1(C)C
InChIInChI=1S/C9H20N2.C2H6/c1-8(2)6-10-7-9(3,4)11(8)5;1-2/h10H,6-7H2,1-5H3;1-2H3
InChIKeyDIHIZGHJKOTHOR-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.10
Rot. Bonds

About ethane;1,2,2,6,6-pentamethylpiperazine

ethane;1,2,2,6,6-pentamethylpiperazine (PubChem CID 168918008) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is ethane;1,2,2,6,6-pentamethylpiperazine.

Molecular Properties

Compound Nameethane;1,2,2,6,6-pentamethylpiperazine
PubChem CID168918008
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Nameethane;1,2,2,6,6-pentamethylpiperazine
SMILESCC.CN1C(C)(C)CNCC1(C)C
InChIInChI=1S/C9H20N2.C2H6/c1-8(2)6-10-7-9(3,4)11(8)5;1-2/h10H,6-7H2,1-5H3;1-2H3
InChIKeyDIHIZGHJKOTHOR-UHFFFAOYSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(2,2,6,6-tetramethylpiperazin-1-yl)methanone
CID 174397328
ethane;2,2,6,6-tetramethylpiperazine
CID 178166936
3a,5,6a-trimethyl-2,3,4,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrole;dihydrochloride
CID 126796964
1,2,2,6,6-pentamethylpiperidine
CID 6603
1,2,2,7,7-pentamethylazepane
CID 22946774
1-bromo-5,5-dimethylimidazolidine
CID 151201573
3a-fluoro-5,6a-dimethyl-2,3,4,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 176992944
3,3-diethylazetidine;hydrochloride
CID 119032125
1,2,2,6,6-pentamethylpiperidine iodide
CID 5315073
1,5-dimethyl-3-azabicyclo[3.1.0]hexane
CID 23049859
1,5-dimethyl-3-azabicyclo[3.2.0]heptane
CID 23049848
3-fluoro-1,3-dimethylazetidine;3-fluoro-3-methylazetidine;3-fluoro-3-methyloxetane
CID 162174730

Frequently Asked Questions

What is the IUPAC name of ethane;1,2,2,6,6-pentamethylpiperazine?
The IUPAC name of ethane;1,2,2,6,6-pentamethylpiperazine (CID 168918008) is ethane;1,2,2,6,6-pentamethylpiperazine.
What is the SMILES notation for ethane;1,2,2,6,6-pentamethylpiperazine?
The canonical SMILES for ethane;1,2,2,6,6-pentamethylpiperazine is CC.CN1C(C)(C)CNCC1(C)C.
What is the InChIKey of ethane;1,2,2,6,6-pentamethylpiperazine?
The InChIKey is DIHIZGHJKOTHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2.C2H6/c1-8(2)6-10-7-9(3,4)11(8)5;1-2/h10H,6-7H2,1-5H3;1-2H3.
What are the key properties of ethane;1,2,2,6,6-pentamethylpiperazine?
ethane;1,2,2,6,6-pentamethylpiperazine has a molecular weight of 186.34 g/mol, XLogP of 2.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,2,2,6,6-pentamethylpiperazine is sourced from PubChem (CID 168918008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).