1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine

C13H27N3 — CID 2846296

IUPAC1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine
SMILESCCN1CCC(N2CCN(CC)CC2)CC1
InChIInChI=1S/C13H27N3/c1-3-14-7-5-13(6-8-14)16-11-9-15(4-2)10-12-16/h13H,3-12H2,1-2H3
InChIKeyMBHXNBGFVYWLML-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.11
Rot. Bonds3

About 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine

1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine (PubChem CID 2846296) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine.

Molecular Properties

Compound Name1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine
PubChem CID2846296
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine
SMILESCCN1CCC(N2CCN(CC)CC2)CC1
InChIInChI=1S/C13H27N3/c1-3-14-7-5-13(6-8-14)16-11-9-15(4-2)10-12-16/h13H,3-12H2,1-2H3
InChIKeyMBHXNBGFVYWLML-UHFFFAOYSA-N
XLogP1.11
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine?
The IUPAC name of 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine (CID 2846296) is 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine.
What is the SMILES notation for 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine?
The canonical SMILES for 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine is CCN1CCC(N2CCN(CC)CC2)CC1.
What is the InChIKey of 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine?
The InChIKey is MBHXNBGFVYWLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-3-14-7-5-13(6-8-14)16-11-9-15(4-2)10-12-16/h13H,3-12H2,1-2H3.
What are the key properties of 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine?
1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine has a molecular weight of 225.38 g/mol, XLogP of 1.11, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(1-ethylpiperidin-4-yl)piperazine is sourced from PubChem (CID 2846296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).