ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine

C17H38N2 — CID 143122946

IUPACethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine
SMILESCC.CC.CN1CCC(CCN2CCCCC2)CC1
InChIInChI=1S/C13H26N2.2C2H6/c1-14-10-5-13(6-11-14)7-12-15-8-3-2-4-9-15;2*1-2/h13H,2-12H2,1H3;2*1-2H3
InChIKeyCNPAGXYXQQTFGS-UHFFFAOYSA-N
MW270.50 g/mol
LogP4.26
Rot. Bonds3

About ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine

ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine (PubChem CID 143122946) has the molecular formula C17H38N2 and a molecular weight of 270.50 g/mol. Its IUPAC name is ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine.

Molecular Properties

Compound Nameethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine
PubChem CID143122946
Molecular FormulaC17H38N2
Molecular Weight270.50 g/mol
Exact Mass270.30
IUPAC Nameethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine
SMILESCC.CC.CN1CCC(CCN2CCCCC2)CC1
InChIInChI=1S/C13H26N2.2C2H6/c1-14-10-5-13(6-11-14)7-12-15-8-3-2-4-9-15;2*1-2/h13H,2-12H2,1H3;2*1-2H3
InChIKeyCNPAGXYXQQTFGS-UHFFFAOYSA-N
XLogP4.26
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.50
LogP ≤ 54.26
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 ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine?
The IUPAC name of ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine (CID 143122946) is ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine.
What is the SMILES notation for ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine?
The canonical SMILES for ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine is CC.CC.CN1CCC(CCN2CCCCC2)CC1.
What is the InChIKey of ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine?
The InChIKey is CNPAGXYXQQTFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2.2C2H6/c1-14-10-5-13(6-11-14)7-12-15-8-3-2-4-9-15;2*1-2/h13H,2-12H2,1H3;2*1-2H3.
What are the key properties of ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine?
ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine has a molecular weight of 270.50 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-4-(2-piperidin-1-ylethyl)piperidine is sourced from PubChem (CID 143122946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).