4-[1-(1H-imidazol-5-yl)ethenyl]piperidine

C10H15N3 — CID 11275349

IUPAC4-[1-(1H-imidazol-5-yl)ethenyl]piperidine
SMILESC=C(c1cnc[nH]1)C1CCNCC1
InChIInChI=1S/C10H15N3/c1-8(10-6-12-7-13-10)9-2-4-11-5-3-9/h6-7,9,11H,1-5H2,(H,12,13)
InChIKeySHLFGPWXEGNEBK-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.42
Rot. Bonds2

About 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine

4-[1-(1H-imidazol-5-yl)ethenyl]piperidine (PubChem CID 11275349) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine.

Molecular Properties

Compound Name4-[1-(1H-imidazol-5-yl)ethenyl]piperidine
PubChem CID11275349
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name4-[1-(1H-imidazol-5-yl)ethenyl]piperidine
SMILESC=C(c1cnc[nH]1)C1CCNCC1
InChIInChI=1S/C10H15N3/c1-8(10-6-12-7-13-10)9-2-4-11-5-3-9/h6-7,9,11H,1-5H2,(H,12,13)
InChIKeySHLFGPWXEGNEBK-UHFFFAOYSA-N
XLogP1.42
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine?
The IUPAC name of 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine (CID 11275349) is 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine.
What is the SMILES notation for 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine?
The canonical SMILES for 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine is C=C(c1cnc[nH]1)C1CCNCC1.
What is the InChIKey of 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine?
The InChIKey is SHLFGPWXEGNEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-8(10-6-12-7-13-10)9-2-4-11-5-3-9/h6-7,9,11H,1-5H2,(H,12,13).
What are the key properties of 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine?
4-[1-(1H-imidazol-5-yl)ethenyl]piperidine has a molecular weight of 177.25 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1H-imidazol-5-yl)ethenyl]piperidine is sourced from PubChem (CID 11275349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).