3-(3-piperazin-1-ylpropyl)cinnoline

Name: 3-(3-piperazin-1-ylpropyl)cinnoline — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₂₀N₄ — CID 116988016

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-(3-piperazin-1-ylpropyl)cinnoline

SMILESc1ccc2nnc(CCCN3CCNCC3)cc2c1

InChIInChI=1S/C15H20N4/c1-2-6-15-13(4-1)12-14(17-18-15)5-3-9-19-10-7-16-8-11-19/h1-2,4,6,12,16H,3,5,7-11H2

InChIKeyIHPFPJKNXYSBMF-UHFFFAOYSA-N

MW256.35 g/mol

LogP1.47

Rot. Bonds4

About 3-(3-piperazin-1-ylpropyl)cinnoline

3-(3-piperazin-1-ylpropyl)cinnoline (PubChem CID 116988016) has the molecular formula C₁₅H₂₀N₄ and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-(3-piperazin-1-ylpropyl)cinnoline.

Molecular Properties

Compound Name	3-(3-piperazin-1-ylpropyl)cinnoline
PubChem CID	116988016
Molecular Formula	C₁₅H₂₀N₄
Molecular Weight	256.35 g/mol
Exact Mass	256.17
IUPAC Name	3-(3-piperazin-1-ylpropyl)cinnoline
SMILES	c1ccc2nnc(CCCN3CCNCC3)cc2c1
InChI	InChI=1S/C15H20N4/c1-2-6-15-13(4-1)12-14(17-18-15)5-3-9-19-10-7-16-8-11-19/h1-2,4,6,12,16H,3,5,7-11H2
InChIKey	IHPFPJKNXYSBMF-UHFFFAOYSA-N
XLogP	1.47
TPSA	41.05 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	19
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	256.35
LogP ≤ 5	1.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-(3-piperazin-1-ylpropyl)cinnoline?

The IUPAC name of 3-(3-piperazin-1-ylpropyl)cinnoline (CID 116988016) is 3-(3-piperazin-1-ylpropyl)cinnoline.

What is the SMILES notation for 3-(3-piperazin-1-ylpropyl)cinnoline?

The canonical SMILES for 3-(3-piperazin-1-ylpropyl)cinnoline is c1ccc2nnc(CCCN3CCNCC3)cc2c1.

What is the InChIKey of 3-(3-piperazin-1-ylpropyl)cinnoline?

The InChIKey is IHPFPJKNXYSBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-6-15-13(4-1)12-14(17-18-15)5-3-9-19-10-7-16-8-11-19/h1-2,4,6,12,16H,3,5,7-11H2.

What are the key properties of 3-(3-piperazin-1-ylpropyl)cinnoline?

3-(3-piperazin-1-ylpropyl)cinnoline has a molecular weight of 256.35 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3-piperazin-1-ylpropyl)cinnoline is sourced from PubChem (CID 116988016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 116988016 — identifiers, structure, computed properties (public domain)

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