8-pyridin-2-yl-7H-purine

C10H7N5 — CID 11680001

IUPAC8-pyridin-2-yl-7H-purine
SMILESc1ccc(-c2nc3ncncc3[nH]2)nc1
InChIInChI=1S/C10H7N5/c1-2-4-12-7(3-1)10-14-8-5-11-6-13-9(8)15-10/h1-6H,(H,11,13,14,15)
InChIKeyIKLBKJSFSNHGKO-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.41
Rot. Bonds1

About 8-pyridin-2-yl-7H-purine

8-pyridin-2-yl-7H-purine (PubChem CID 11680001) has the molecular formula C10H7N5 and a molecular weight of 197.20 g/mol. Its IUPAC name is 8-pyridin-2-yl-7H-purine.

Molecular Properties

Compound Name8-pyridin-2-yl-7H-purine
PubChem CID11680001
Molecular FormulaC10H7N5
Molecular Weight197.20 g/mol
Exact Mass197.07
IUPAC Name8-pyridin-2-yl-7H-purine
SMILESc1ccc(-c2nc3ncncc3[nH]2)nc1
InChIInChI=1S/C10H7N5/c1-2-4-12-7(3-1)10-14-8-5-11-6-13-9(8)15-10/h1-6H,(H,11,13,14,15)
InChIKeyIKLBKJSFSNHGKO-UHFFFAOYSA-N
XLogP1.41
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 8-pyridin-2-yl-7H-purine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-pyridin-2-yl-7H-purine?
The IUPAC name of 8-pyridin-2-yl-7H-purine (CID 11680001) is 8-pyridin-2-yl-7H-purine.
What is the SMILES notation for 8-pyridin-2-yl-7H-purine?
The canonical SMILES for 8-pyridin-2-yl-7H-purine is c1ccc(-c2nc3ncncc3[nH]2)nc1.
What is the InChIKey of 8-pyridin-2-yl-7H-purine?
The InChIKey is IKLBKJSFSNHGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5/c1-2-4-12-7(3-1)10-14-8-5-11-6-13-9(8)15-10/h1-6H,(H,11,13,14,15).
What are the key properties of 8-pyridin-2-yl-7H-purine?
8-pyridin-2-yl-7H-purine has a molecular weight of 197.20 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-pyridin-2-yl-7H-purine is sourced from PubChem (CID 11680001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).