4-(2-naphthalen-2-ylimidazol-1-yl)piperidine

C18H19N3 — CID 68729306

IUPAC4-(2-naphthalen-2-ylimidazol-1-yl)piperidine
SMILESc1ccc2cc(-c3nccn3C3CCNCC3)ccc2c1
InChIInChI=1S/C18H19N3/c1-2-4-15-13-16(6-5-14(15)3-1)18-20-11-12-21(18)17-7-9-19-10-8-17/h1-6,11-13,17,19H,7-10H2
InChIKeyHYWOSCYEUJDWLI-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.63
Rot. Bonds2

About 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine

4-(2-naphthalen-2-ylimidazol-1-yl)piperidine (PubChem CID 68729306) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine.

Molecular Properties

Compound Name4-(2-naphthalen-2-ylimidazol-1-yl)piperidine
PubChem CID68729306
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name4-(2-naphthalen-2-ylimidazol-1-yl)piperidine
SMILESc1ccc2cc(-c3nccn3C3CCNCC3)ccc2c1
InChIInChI=1S/C18H19N3/c1-2-4-15-13-16(6-5-14(15)3-1)18-20-11-12-21(18)17-7-9-19-10-8-17/h1-6,11-13,17,19H,7-10H2
InChIKeyHYWOSCYEUJDWLI-UHFFFAOYSA-N
XLogP3.63
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine?
The IUPAC name of 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine (CID 68729306) is 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine.
What is the SMILES notation for 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine?
The canonical SMILES for 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine is c1ccc2cc(-c3nccn3C3CCNCC3)ccc2c1.
What is the InChIKey of 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine?
The InChIKey is HYWOSCYEUJDWLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-2-4-15-13-16(6-5-14(15)3-1)18-20-11-12-21(18)17-7-9-19-10-8-17/h1-6,11-13,17,19H,7-10H2.
What are the key properties of 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine?
4-(2-naphthalen-2-ylimidazol-1-yl)piperidine has a molecular weight of 277.37 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-naphthalen-2-ylimidazol-1-yl)piperidine is sourced from PubChem (CID 68729306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).