3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol

C12H19N3O — CID 117148607

IUPAC3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
SMILESOC1CCc2cnc(CC3CCCN3)n2C1
InChIInChI=1S/C12H19N3O/c16-11-4-3-10-7-14-12(15(10)8-11)6-9-2-1-5-13-9/h7,9,11,13,16H,1-6,8H2
InChIKeyBLLLEFLSMNUIOT-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.48
Rot. Bonds2

About 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol

3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol (PubChem CID 117148607) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol.

Molecular Properties

Compound Name3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
PubChem CID117148607
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol
SMILESOC1CCc2cnc(CC3CCCN3)n2C1
InChIInChI=1S/C12H19N3O/c16-11-4-3-10-7-14-12(15(10)8-11)6-9-2-1-5-13-9/h7,9,11,13,16H,1-6,8H2
InChIKeyBLLLEFLSMNUIOT-UHFFFAOYSA-N
XLogP0.48
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol?
The IUPAC name of 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol (CID 117148607) is 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol.
What is the SMILES notation for 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol?
The canonical SMILES for 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol is OC1CCc2cnc(CC3CCCN3)n2C1.
What is the InChIKey of 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol?
The InChIKey is BLLLEFLSMNUIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c16-11-4-3-10-7-14-12(15(10)8-11)6-9-2-1-5-13-9/h7,9,11,13,16H,1-6,8H2.
What are the key properties of 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol?
3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol has a molecular weight of 221.30 g/mol, XLogP of 0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-6-ol is sourced from PubChem (CID 117148607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).