4-(azet-2-yl)piperidine

C8H12N2 — CID 142245493

IUPAC4-(azet-2-yl)piperidine
SMILESC1=CC(C2CCNCC2)=N1
InChIInChI=1S/C8H12N2/c1-4-9-5-2-7(1)8-3-6-10-8/h3,6-7,9H,1-2,4-5H2
InChIKeySGBOZJCJWHZUHD-UHFFFAOYSA-N
MW136.20 g/mol
LogP0.95
Rot. Bonds1

About 4-(azet-2-yl)piperidine

4-(azet-2-yl)piperidine (PubChem CID 142245493) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 4-(azet-2-yl)piperidine.

Molecular Properties

Compound Name4-(azet-2-yl)piperidine
PubChem CID142245493
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name4-(azet-2-yl)piperidine
SMILESC1=CC(C2CCNCC2)=N1
InChIInChI=1S/C8H12N2/c1-4-9-5-2-7(1)8-3-6-10-8/h3,6-7,9H,1-2,4-5H2
InChIKeySGBOZJCJWHZUHD-UHFFFAOYSA-N
XLogP0.95
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(azet-2-yl)piperidine?
The IUPAC name of 4-(azet-2-yl)piperidine (CID 142245493) is 4-(azet-2-yl)piperidine.
What is the SMILES notation for 4-(azet-2-yl)piperidine?
The canonical SMILES for 4-(azet-2-yl)piperidine is C1=CC(C2CCNCC2)=N1.
What is the InChIKey of 4-(azet-2-yl)piperidine?
The InChIKey is SGBOZJCJWHZUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-4-9-5-2-7(1)8-3-6-10-8/h3,6-7,9H,1-2,4-5H2.
What are the key properties of 4-(azet-2-yl)piperidine?
4-(azet-2-yl)piperidine has a molecular weight of 136.20 g/mol, XLogP of 0.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azet-2-yl)piperidine is sourced from PubChem (CID 142245493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).