(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol

C12H20N4O — CID 116984493

IUPAC(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
SMILESOCc1nc(N2CCNCC2)n2c1CCCC2
InChIInChI=1S/C12H20N4O/c17-9-10-11-3-1-2-6-16(11)12(14-10)15-7-4-13-5-8-15/h13,17H,1-9H2
InChIKeyMFDANARYEXZFFV-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.12
Rot. Bonds2

About (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol

(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol (PubChem CID 116984493) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol.

Molecular Properties

Compound Name(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
PubChem CID116984493
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
SMILESOCc1nc(N2CCNCC2)n2c1CCCC2
InChIInChI=1S/C12H20N4O/c17-9-10-11-3-1-2-6-16(11)12(14-10)15-7-4-13-5-8-15/h13,17H,1-9H2
InChIKeyMFDANARYEXZFFV-UHFFFAOYSA-N
XLogP0.12
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol?
The IUPAC name of (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol (CID 116984493) is (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol.
What is the SMILES notation for (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol?
The canonical SMILES for (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol is OCc1nc(N2CCNCC2)n2c1CCCC2.
What is the InChIKey of (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol?
The InChIKey is MFDANARYEXZFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c17-9-10-11-3-1-2-6-16(11)12(14-10)15-7-4-13-5-8-15/h13,17H,1-9H2.
What are the key properties of (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol?
(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol has a molecular weight of 236.32 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol is sourced from PubChem (CID 116984493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).