3-piperazin-1-yl-1,5-naphthyridine

C12H14N4 — CID 174919144

IUPAC3-piperazin-1-yl-1,5-naphthyridine
SMILESc1cnc2cc(N3CCNCC3)cnc2c1
InChIInChI=1S/C12H14N4/c1-2-11-12(14-3-1)8-10(9-15-11)16-6-4-13-5-7-16/h1-3,8-9,13H,4-7H2
InChIKeyARYPBMQXFNLUSP-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.04
Rot. Bonds1

About 3-piperazin-1-yl-1,5-naphthyridine

3-piperazin-1-yl-1,5-naphthyridine (PubChem CID 174919144) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-piperazin-1-yl-1,5-naphthyridine.

Molecular Properties

Compound Name3-piperazin-1-yl-1,5-naphthyridine
PubChem CID174919144
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name3-piperazin-1-yl-1,5-naphthyridine
SMILESc1cnc2cc(N3CCNCC3)cnc2c1
InChIInChI=1S/C12H14N4/c1-2-11-12(14-3-1)8-10(9-15-11)16-6-4-13-5-7-16/h1-3,8-9,13H,4-7H2
InChIKeyARYPBMQXFNLUSP-UHFFFAOYSA-N
XLogP1.04
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-piperazin-1-yl-1,5-naphthyridine?
The IUPAC name of 3-piperazin-1-yl-1,5-naphthyridine (CID 174919144) is 3-piperazin-1-yl-1,5-naphthyridine.
What is the SMILES notation for 3-piperazin-1-yl-1,5-naphthyridine?
The canonical SMILES for 3-piperazin-1-yl-1,5-naphthyridine is c1cnc2cc(N3CCNCC3)cnc2c1.
What is the InChIKey of 3-piperazin-1-yl-1,5-naphthyridine?
The InChIKey is ARYPBMQXFNLUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-2-11-12(14-3-1)8-10(9-15-11)16-6-4-13-5-7-16/h1-3,8-9,13H,4-7H2.
What are the key properties of 3-piperazin-1-yl-1,5-naphthyridine?
3-piperazin-1-yl-1,5-naphthyridine has a molecular weight of 214.27 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperazin-1-yl-1,5-naphthyridine is sourced from PubChem (CID 174919144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).