5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine

C13H18N4 — CID 83894473

IUPAC5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine
SMILESc1cc(CCN2CCNCC2)n2cncc2c1
InChIInChI=1S/C13H18N4/c1-2-12(17-11-15-10-13(17)3-1)4-7-16-8-5-14-6-9-16/h1-3,10-11,14H,4-9H2
InChIKeyMIRAGEDAJITBRG-UHFFFAOYSA-N
MW230.32 g/mol
LogP0.78
Rot. Bonds3

About 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine

5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine (PubChem CID 83894473) has the molecular formula C13H18N4 and a molecular weight of 230.32 g/mol. Its IUPAC name is 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine
PubChem CID83894473
Molecular FormulaC13H18N4
Molecular Weight230.32 g/mol
Exact Mass230.15
IUPAC Name5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine
SMILESc1cc(CCN2CCNCC2)n2cncc2c1
InChIInChI=1S/C13H18N4/c1-2-12(17-11-15-10-13(17)3-1)4-7-16-8-5-14-6-9-16/h1-3,10-11,14H,4-9H2
InChIKeyMIRAGEDAJITBRG-UHFFFAOYSA-N
XLogP0.78
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.32
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 82606001
5-(2-piperazin-1-ylethyl)isoquinoline
CID 117355834
1-(3-pyridin-3-ylpropyl)piperazine;trihydrochloride
CID 86694323
bis(1-(2-phenylethyl)piperazine);dihydrochloride
CID 102602644
3-methyl-5-(piperazin-1-ylmethyl)imidazo[1,5-a]pyridine
CID 83840549
1-[2-(3-bromo-4-pyridinyl)ethyl]piperazine
CID 84712711
5-(4-piperazin-1-ylbutyl)pyrimidine
CID 121009202
2-methyl-3-(2-piperazin-1-ylethyl)indolizine
CID 116993644
1-[2-(3-bromophenyl)ethyl]piperazine
CID 53407154
3-(2-piperazin-1-ylethyl)aniline
CID 82071066
8-bromo-3-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine
CID 84744350
1-[2-(5-fluoro-3-pyridinyl)ethyl]piperazine
CID 82507856

Frequently Asked Questions

What is the IUPAC name of 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine (CID 83894473) is 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine is c1cc(CCN2CCNCC2)n2cncc2c1.
What is the InChIKey of 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine?
The InChIKey is MIRAGEDAJITBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-2-12(17-11-15-10-13(17)3-1)4-7-16-8-5-14-6-9-16/h1-3,10-11,14H,4-9H2.
What are the key properties of 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine?
5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine has a molecular weight of 230.32 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-piperazin-1-ylethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 83894473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).