2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol

C13H10BrN3O — CID 137005590

IUPAC2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol
SMILESNc1cccc2c(Br)nc(-c3ccccc3O)n12
InChIInChI=1S/C13H10BrN3O/c14-12-9-5-3-7-11(15)17(9)13(16-12)8-4-1-2-6-10(8)18/h1-7,18H,15H2
InChIKeyFYOMFMJKDMMDMN-UHFFFAOYSA-N
MW304.15 g/mol
LogP3.05
Rot. Bonds1

About 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol

2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol (PubChem CID 137005590) has the molecular formula C13H10BrN3O and a molecular weight of 304.15 g/mol. Its IUPAC name is 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol.

Molecular Properties

Compound Name2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol
PubChem CID137005590
Molecular FormulaC13H10BrN3O
Molecular Weight304.15 g/mol
Exact Mass303.00
IUPAC Name2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol
SMILESNc1cccc2c(Br)nc(-c3ccccc3O)n12
InChIInChI=1S/C13H10BrN3O/c14-12-9-5-3-7-11(15)17(9)13(16-12)8-4-1-2-6-10(8)18/h1-7,18H,15H2
InChIKeyFYOMFMJKDMMDMN-UHFFFAOYSA-N
XLogP3.05
TPSA63.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.15
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol?
The IUPAC name of 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol (CID 137005590) is 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol.
What is the SMILES notation for 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol?
The canonical SMILES for 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol is Nc1cccc2c(Br)nc(-c3ccccc3O)n12.
What is the InChIKey of 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol?
The InChIKey is FYOMFMJKDMMDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3O/c14-12-9-5-3-7-11(15)17(9)13(16-12)8-4-1-2-6-10(8)18/h1-7,18H,15H2.
What are the key properties of 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol?
2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol has a molecular weight of 304.15 g/mol, XLogP of 3.05, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1-bromoimidazo[1,5-a]pyridin-3-yl)phenol is sourced from PubChem (CID 137005590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).