bis(1,4-dimethylpiperidine);ethane

C16H36N2 — CID 143376353

IUPACbis(1,4-dimethylpiperidine);ethane
SMILESCC.CC1CCN(C)CC1.CC1CCN(C)CC1
InChIInChI=1S/2C7H15N.C2H6/c2*1-7-3-5-8(2)6-4-7;1-2/h2*7H,3-6H2,1-2H3;1-2H3
InChIKeyXPOAZSYVVCYGDR-UHFFFAOYSA-N
MW256.48 g/mol
LogP3.72
Rot. Bonds

About bis(1,4-dimethylpiperidine);ethane

bis(1,4-dimethylpiperidine);ethane (PubChem CID 143376353) has the molecular formula C16H36N2 and a molecular weight of 256.48 g/mol. Its IUPAC name is bis(1,4-dimethylpiperidine);ethane.

Molecular Properties

Compound Namebis(1,4-dimethylpiperidine);ethane
PubChem CID143376353
Molecular FormulaC16H36N2
Molecular Weight256.48 g/mol
Exact Mass256.29
IUPAC Namebis(1,4-dimethylpiperidine);ethane
SMILESCC.CC1CCN(C)CC1.CC1CCN(C)CC1
InChIInChI=1S/2C7H15N.C2H6/c2*1-7-3-5-8(2)6-4-7;1-2/h2*7H,3-6H2,1-2H3;1-2H3
InChIKeyXPOAZSYVVCYGDR-UHFFFAOYSA-N
XLogP3.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.48
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(3,3-Dimethylpiperidin-1-yl)butyl]-3,3-dimethylpiperidine;hydrochloride
CID 57402902
1-Methyl-1-azoniabicyclo[2.2.2]octane
CID 155481
Piperidinium, 1-methyl-1-propyl-4-(2-(propyldimethylammonio)ethyl)-, diiodide
CID 3048556
Piperidinium, 1,1',1'-trimethyl-1,4'-ethylenedi-, diiodide
CID 3048569
1,1'-Dimethyl-4,4'-bipiperidine
CID 177611
1,3-Di-(3-methylpiperidino)propane dihydrochloride
CID 13610537
1,4-Di-(3-methylpiperidino)butane dihydrochloride
CID 13794402
1-(2-Methyl-4-piperidin-1-ylbutyl)piperidine
CID 11128366
4,4'-Dimethyl-[1,1']bipiperidinyl
CID 12402790
1-Ethyl-1-azabicyclo[2.2.2]octan-1-ium
CID 13652288
1-Propyl-1-azoniabicyclo[2.2.2]octane
CID 14642664
1-Butyl-1-azoniabicyclo[2.2.2]octane
CID 14642666

Frequently Asked Questions

What is the IUPAC name of bis(1,4-dimethylpiperidine);ethane?
The IUPAC name of bis(1,4-dimethylpiperidine);ethane (CID 143376353) is bis(1,4-dimethylpiperidine);ethane.
What is the SMILES notation for bis(1,4-dimethylpiperidine);ethane?
The canonical SMILES for bis(1,4-dimethylpiperidine);ethane is CC.CC1CCN(C)CC1.CC1CCN(C)CC1.
What is the InChIKey of bis(1,4-dimethylpiperidine);ethane?
The InChIKey is XPOAZSYVVCYGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H15N.C2H6/c2*1-7-3-5-8(2)6-4-7;1-2/h2*7H,3-6H2,1-2H3;1-2H3.
What are the key properties of bis(1,4-dimethylpiperidine);ethane?
bis(1,4-dimethylpiperidine);ethane has a molecular weight of 256.48 g/mol, XLogP of 3.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,4-dimethylpiperidine);ethane is sourced from PubChem (CID 143376353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).