4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine

C18H36N2 — CID 83199232

IUPAC4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine
SMILESCCC1(CC)CCN(CC(C)(C)C2CCCNC2)CC1
InChIInChI=1S/C18H36N2/c1-5-18(6-2)9-12-20(13-10-18)15-17(3,4)16-8-7-11-19-14-16/h16,19H,5-15H2,1-4H3
InChIKeyFJGXNMVZCAENHT-UHFFFAOYSA-N
MW280.50 g/mol
LogP3.91
Rot. Bonds5

About 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine

4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine (PubChem CID 83199232) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine.

Molecular Properties

Compound Name4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine
PubChem CID83199232
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine
SMILESCCC1(CC)CCN(CC(C)(C)C2CCCNC2)CC1
InChIInChI=1S/C18H36N2/c1-5-18(6-2)9-12-20(13-10-18)15-17(3,4)16-8-7-11-19-14-16/h16,19H,5-15H2,1-4H3
InChIKeyFJGXNMVZCAENHT-UHFFFAOYSA-N
XLogP3.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine?
The IUPAC name of 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine (CID 83199232) is 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine.
What is the SMILES notation for 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine?
The canonical SMILES for 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine is CCC1(CC)CCN(CC(C)(C)C2CCCNC2)CC1.
What is the InChIKey of 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine?
The InChIKey is FJGXNMVZCAENHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-5-18(6-2)9-12-20(13-10-18)15-17(3,4)16-8-7-11-19-14-16/h16,19H,5-15H2,1-4H3.
What are the key properties of 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine?
4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine has a molecular weight of 280.50 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethyl-1-(2-methyl-2-piperidin-3-ylpropyl)piperidine is sourced from PubChem (CID 83199232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).