4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol

C16H15N3O — CID 86281226

IUPAC4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2cn3ccc(N4CCC4)cc3n2)cc1
InChIInChI=1S/C16H15N3O/c20-14-4-2-12(3-5-14)15-11-19-9-6-13(10-16(19)17-15)18-7-1-8-18/h2-6,9-11,20H,1,7-8H2
InChIKeyRKHNURRRKPUUCY-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.92
Rot. Bonds2

About 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol

4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 86281226) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID86281226
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2cn3ccc(N4CCC4)cc3n2)cc1
InChIInChI=1S/C16H15N3O/c20-14-4-2-12(3-5-14)15-11-19-9-6-13(10-16(19)17-15)18-7-1-8-18/h2-6,9-11,20H,1,7-8H2
InChIKeyRKHNURRRKPUUCY-UHFFFAOYSA-N
XLogP2.92
TPSA40.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol (CID 86281226) is 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol is Oc1ccc(-c2cn3ccc(N4CCC4)cc3n2)cc1.
What is the InChIKey of 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is RKHNURRRKPUUCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c20-14-4-2-12(3-5-14)15-11-19-9-6-13(10-16(19)17-15)18-7-1-8-18/h2-6,9-11,20H,1,7-8H2.
What are the key properties of 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol?
4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 265.32 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(azetidin-1-yl)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 86281226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).