2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol

C9H10ClN3O — CID 83885645

IUPAC2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol
SMILESNCC(O)c1ccc2c(Cl)ncn2c1
InChIInChI=1S/C9H10ClN3O/c10-9-7-2-1-6(8(14)3-11)4-13(7)5-12-9/h1-2,4-5,8,14H,3,11H2
InChIKeyWLLWCKQTMZVKTK-UHFFFAOYSA-N
MW211.65 g/mol
LogP0.98
Rot. Bonds2

About 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol

2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol (PubChem CID 83885645) has the molecular formula C9H10ClN3O and a molecular weight of 211.65 g/mol. Its IUPAC name is 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol
PubChem CID83885645
Molecular FormulaC9H10ClN3O
Molecular Weight211.65 g/mol
Exact Mass211.05
IUPAC Name2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol
SMILESNCC(O)c1ccc2c(Cl)ncn2c1
InChIInChI=1S/C9H10ClN3O/c10-9-7-2-1-6(8(14)3-11)4-13(7)5-12-9/h1-2,4-5,8,14H,3,11H2
InChIKeyWLLWCKQTMZVKTK-UHFFFAOYSA-N
XLogP0.98
TPSA63.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol?
The IUPAC name of 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol (CID 83885645) is 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol.
What is the SMILES notation for 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol?
The canonical SMILES for 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol is NCC(O)c1ccc2c(Cl)ncn2c1.
What is the InChIKey of 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol?
The InChIKey is WLLWCKQTMZVKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3O/c10-9-7-2-1-6(8(14)3-11)4-13(7)5-12-9/h1-2,4-5,8,14H,3,11H2.
What are the key properties of 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol?
2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol has a molecular weight of 211.65 g/mol, XLogP of 0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(1-chloroimidazo[1,5-a]pyridin-6-yl)ethanol is sourced from PubChem (CID 83885645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).