3-(2-ethylimidazol-1-yl)piperidine

C10H17N3 — CID 54592639

IUPAC3-(2-ethylimidazol-1-yl)piperidine
SMILESCCc1nccn1C1CCCNC1
InChIInChI=1S/C10H17N3/c1-2-10-12-6-7-13(10)9-4-3-5-11-8-9/h6-7,9,11H,2-5,8H2,1H3
InChIKeyPBPIFPBYNAOWNT-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.37
Rot. Bonds2

About 3-(2-ethylimidazol-1-yl)piperidine

3-(2-ethylimidazol-1-yl)piperidine (PubChem CID 54592639) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-(2-ethylimidazol-1-yl)piperidine.

Molecular Properties

Compound Name3-(2-ethylimidazol-1-yl)piperidine
PubChem CID54592639
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-(2-ethylimidazol-1-yl)piperidine
SMILESCCc1nccn1C1CCCNC1
InChIInChI=1S/C10H17N3/c1-2-10-12-6-7-13(10)9-4-3-5-11-8-9/h6-7,9,11H,2-5,8H2,1H3
InChIKeyPBPIFPBYNAOWNT-UHFFFAOYSA-N
XLogP1.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylimidazol-1-yl)piperidine?
The IUPAC name of 3-(2-ethylimidazol-1-yl)piperidine (CID 54592639) is 3-(2-ethylimidazol-1-yl)piperidine.
What is the SMILES notation for 3-(2-ethylimidazol-1-yl)piperidine?
The canonical SMILES for 3-(2-ethylimidazol-1-yl)piperidine is CCc1nccn1C1CCCNC1.
What is the InChIKey of 3-(2-ethylimidazol-1-yl)piperidine?
The InChIKey is PBPIFPBYNAOWNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-10-12-6-7-13(10)9-4-3-5-11-8-9/h6-7,9,11H,2-5,8H2,1H3.
What are the key properties of 3-(2-ethylimidazol-1-yl)piperidine?
3-(2-ethylimidazol-1-yl)piperidine has a molecular weight of 179.27 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylimidazol-1-yl)piperidine is sourced from PubChem (CID 54592639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).