3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol

C13H17N3O — CID 117142363

IUPAC3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2cnc(CCN3CCCC3)n12
InChIInChI=1S/C13H17N3O/c17-13-5-3-4-11-10-14-12(16(11)13)6-9-15-7-1-2-8-15/h3-5,10,17H,1-2,6-9H2
InChIKeyQNBNVXSAHLYVID-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.68
Rot. Bonds3

About 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol

3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol (PubChem CID 117142363) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol.

Molecular Properties

Compound Name3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol
PubChem CID117142363
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2cnc(CCN3CCCC3)n12
InChIInChI=1S/C13H17N3O/c17-13-5-3-4-11-10-14-12(16(11)13)6-9-15-7-1-2-8-15/h3-5,10,17H,1-2,6-9H2
InChIKeyQNBNVXSAHLYVID-UHFFFAOYSA-N
XLogP1.68
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol?
The IUPAC name of 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol (CID 117142363) is 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol.
What is the SMILES notation for 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol?
The canonical SMILES for 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol is Oc1cccc2cnc(CCN3CCCC3)n12.
What is the InChIKey of 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol?
The InChIKey is QNBNVXSAHLYVID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c17-13-5-3-4-11-10-14-12(16(11)13)6-9-15-7-1-2-8-15/h3-5,10,17H,1-2,6-9H2.
What are the key properties of 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol?
3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol has a molecular weight of 231.30 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol is sourced from PubChem (CID 117142363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).