4-pyrrolidin-2-ylpiperidine

C9H18N2 — CID 4715078

IUPAC4-pyrrolidin-2-ylpiperidine
SMILESC1CNC(C2CCNCC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h8-11H,1-7H2
InChIKeyIUZGEJUVHUPYAJ-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.74
Rot. Bonds1

About 4-pyrrolidin-2-ylpiperidine

4-pyrrolidin-2-ylpiperidine (PubChem CID 4715078) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 4-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name4-pyrrolidin-2-ylpiperidine
PubChem CID4715078
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name4-pyrrolidin-2-ylpiperidine
SMILESC1CNC(C2CCNCC2)C1
InChIInChI=1S/C9H18N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h8-11H,1-7H2
InChIKeyIUZGEJUVHUPYAJ-UHFFFAOYSA-N
XLogP0.74
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-2-ylpiperidine?
The IUPAC name of 4-pyrrolidin-2-ylpiperidine (CID 4715078) is 4-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 4-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 4-pyrrolidin-2-ylpiperidine is C1CNC(C2CCNCC2)C1.
What is the InChIKey of 4-pyrrolidin-2-ylpiperidine?
The InChIKey is IUZGEJUVHUPYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-2-9(11-5-1)8-3-6-10-7-4-8/h8-11H,1-7H2.
What are the key properties of 4-pyrrolidin-2-ylpiperidine?
4-pyrrolidin-2-ylpiperidine has a molecular weight of 154.26 g/mol, XLogP of 0.74, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 4715078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).