4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine

C12H23N3 — CID 13473149

IUPAC4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine
SMILESCCN1CCN=C1CCC1CCNCC1
InChIInChI=1S/C12H23N3/c1-2-15-10-9-14-12(15)4-3-11-5-7-13-8-6-11/h11,13H,2-10H2,1H3
InChIKeyPUEFNVONRVBNCJ-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.50
Rot. Bonds4

About 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine

4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine (PubChem CID 13473149) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine
PubChem CID13473149
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine
SMILESCCN1CCN=C1CCC1CCNCC1
InChIInChI=1S/C12H23N3/c1-2-15-10-9-14-12(15)4-3-11-5-7-13-8-6-11/h11,13H,2-10H2,1H3
InChIKeyPUEFNVONRVBNCJ-UHFFFAOYSA-N
XLogP1.50
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine?
The IUPAC name of 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine (CID 13473149) is 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine?
The canonical SMILES for 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine is CCN1CCN=C1CCC1CCNCC1.
What is the InChIKey of 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine?
The InChIKey is PUEFNVONRVBNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-2-15-10-9-14-12(15)4-3-11-5-7-13-8-6-11/h11,13H,2-10H2,1H3.
What are the key properties of 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine?
4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine has a molecular weight of 209.34 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-ethyl-4,5-dihydroimidazol-2-yl)ethyl]piperidine is sourced from PubChem (CID 13473149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).