2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol

C14H13N3O — CID 117146983

IUPAC2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol
SMILESNc1cccn2c(Cc3ccccc3O)ncc12
InChIInChI=1S/C14H13N3O/c15-11-5-3-7-17-12(11)9-16-14(17)8-10-4-1-2-6-13(10)18/h1-7,9,18H,8,15H2
InChIKeyGRPNIGOCSBBYHC-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.21
Rot. Bonds2

About 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol

2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol (PubChem CID 117146983) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol.

Molecular Properties

Compound Name2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol
PubChem CID117146983
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol
SMILESNc1cccn2c(Cc3ccccc3O)ncc12
InChIInChI=1S/C14H13N3O/c15-11-5-3-7-17-12(11)9-16-14(17)8-10-4-1-2-6-13(10)18/h1-7,9,18H,8,15H2
InChIKeyGRPNIGOCSBBYHC-UHFFFAOYSA-N
XLogP2.21
TPSA63.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol?
The IUPAC name of 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol (CID 117146983) is 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol.
What is the SMILES notation for 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol?
The canonical SMILES for 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol is Nc1cccn2c(Cc3ccccc3O)ncc12.
What is the InChIKey of 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol?
The InChIKey is GRPNIGOCSBBYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c15-11-5-3-7-17-12(11)9-16-14(17)8-10-4-1-2-6-13(10)18/h1-7,9,18H,8,15H2.
What are the key properties of 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol?
2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol has a molecular weight of 239.28 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol is sourced from PubChem (CID 117146983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).