7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine

C16H17N5 — CID 117236205

IUPAC7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
SMILESc1ccc(-c2ncc3cc(N4CCNCC4)ccn23)nc1
InChIInChI=1S/C16H17N5/c1-2-5-18-15(3-1)16-19-12-14-11-13(4-8-21(14)16)20-9-6-17-7-10-20/h1-5,8,11-12,17H,6-7,9-10H2
InChIKeyVCKNIQZFMCTYER-UHFFFAOYSA-N
MW279.35 g/mol
LogP1.81
Rot. Bonds2

About 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine

7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine (PubChem CID 117236205) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
PubChem CID117236205
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
SMILESc1ccc(-c2ncc3cc(N4CCNCC4)ccn23)nc1
InChIInChI=1S/C16H17N5/c1-2-5-18-15(3-1)16-19-12-14-11-13(4-8-21(14)16)20-9-6-17-7-10-20/h1-5,8,11-12,17H,6-7,9-10H2
InChIKeyVCKNIQZFMCTYER-UHFFFAOYSA-N
XLogP1.81
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine?
The IUPAC name of 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine (CID 117236205) is 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine is c1ccc(-c2ncc3cc(N4CCNCC4)ccn23)nc1.
What is the InChIKey of 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine?
The InChIKey is VCKNIQZFMCTYER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-2-5-18-15(3-1)16-19-12-14-11-13(4-8-21(14)16)20-9-6-17-7-10-20/h1-5,8,11-12,17H,6-7,9-10H2.
What are the key properties of 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine?
7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine has a molecular weight of 279.35 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 117236205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).