1-(1-ethylpiperidin-4-yl)-4-methylpiperazine

C12H25N3 — CID 784238

IUPAC1-(1-ethylpiperidin-4-yl)-4-methylpiperazine
SMILESCCN1CCC(N2CCN(C)CC2)CC1
InChIInChI=1S/C12H25N3/c1-3-14-6-4-12(5-7-14)15-10-8-13(2)9-11-15/h12H,3-11H2,1-2H3
InChIKeySVOUNFNLVSMMEN-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.72
Rot. Bonds2

About 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine

1-(1-ethylpiperidin-4-yl)-4-methylpiperazine (PubChem CID 784238) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(1-ethylpiperidin-4-yl)-4-methylpiperazine
PubChem CID784238
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name1-(1-ethylpiperidin-4-yl)-4-methylpiperazine
SMILESCCN1CCC(N2CCN(C)CC2)CC1
InChIInChI=1S/C12H25N3/c1-3-14-6-4-12(5-7-14)15-10-8-13(2)9-11-15/h12H,3-11H2,1-2H3
InChIKeySVOUNFNLVSMMEN-UHFFFAOYSA-N
XLogP0.72
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine?
The IUPAC name of 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine (CID 784238) is 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine.
What is the SMILES notation for 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine?
The canonical SMILES for 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine is CCN1CCC(N2CCN(C)CC2)CC1.
What is the InChIKey of 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine?
The InChIKey is SVOUNFNLVSMMEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-3-14-6-4-12(5-7-14)15-10-8-13(2)9-11-15/h12H,3-11H2,1-2H3.
What are the key properties of 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine?
1-(1-ethylpiperidin-4-yl)-4-methylpiperazine has a molecular weight of 211.35 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpiperidin-4-yl)-4-methylpiperazine is sourced from PubChem (CID 784238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).