4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol

C13H11N3O — CID 137006649

IUPAC4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol
SMILESNc1cccn2c(-c3ccc(O)cc3)ncc12
InChIInChI=1S/C13H11N3O/c14-11-2-1-7-16-12(11)8-15-13(16)9-3-5-10(17)6-4-9/h1-8,17H,14H2
InChIKeyXVRHWMFTPABCID-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.29
Rot. Bonds1

About 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol

4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol (PubChem CID 137006649) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol.

Molecular Properties

Compound Name4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol
PubChem CID137006649
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol
SMILESNc1cccn2c(-c3ccc(O)cc3)ncc12
InChIInChI=1S/C13H11N3O/c14-11-2-1-7-16-12(11)8-15-13(16)9-3-5-10(17)6-4-9/h1-8,17H,14H2
InChIKeyXVRHWMFTPABCID-UHFFFAOYSA-N
XLogP2.29
TPSA63.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol?
The IUPAC name of 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol (CID 137006649) is 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol.
What is the SMILES notation for 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol?
The canonical SMILES for 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol is Nc1cccn2c(-c3ccc(O)cc3)ncc12.
What is the InChIKey of 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol?
The InChIKey is XVRHWMFTPABCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c14-11-2-1-7-16-12(11)8-15-13(16)9-3-5-10(17)6-4-9/h1-8,17H,14H2.
What are the key properties of 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol?
4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol has a molecular weight of 225.25 g/mol, XLogP of 2.29, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol is sourced from PubChem (CID 137006649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).