9-(oxolan-2-yl)purine

C9H10N4O — CID 23184999

IUPAC9-(oxolan-2-yl)purine
SMILESc1ncc2ncn(C3CCCO3)c2n1
InChIInChI=1S/C9H10N4O/c1-2-8(14-3-1)13-6-12-7-4-10-5-11-9(7)13/h4-6,8H,1-3H2
InChIKeyDAKONNSVCLKUJN-UHFFFAOYSA-N
MW190.21 g/mol
LogP1.14
Rot. Bonds1

About 9-(oxolan-2-yl)purine

9-(oxolan-2-yl)purine (PubChem CID 23184999) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 9-(oxolan-2-yl)purine.

Molecular Properties

Compound Name9-(oxolan-2-yl)purine
PubChem CID23184999
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name9-(oxolan-2-yl)purine
SMILESc1ncc2ncn(C3CCCO3)c2n1
InChIInChI=1S/C9H10N4O/c1-2-8(14-3-1)13-6-12-7-4-10-5-11-9(7)13/h4-6,8H,1-3H2
InChIKeyDAKONNSVCLKUJN-UHFFFAOYSA-N
XLogP1.14
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-(oxolan-2-yl)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 9-(oxolan-2-yl)purine?
The IUPAC name of 9-(oxolan-2-yl)purine (CID 23184999) is 9-(oxolan-2-yl)purine.
What is the SMILES notation for 9-(oxolan-2-yl)purine?
The canonical SMILES for 9-(oxolan-2-yl)purine is c1ncc2ncn(C3CCCO3)c2n1.
What is the InChIKey of 9-(oxolan-2-yl)purine?
The InChIKey is DAKONNSVCLKUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-2-8(14-3-1)13-6-12-7-4-10-5-11-9(7)13/h4-6,8H,1-3H2.
What are the key properties of 9-(oxolan-2-yl)purine?
9-(oxolan-2-yl)purine has a molecular weight of 190.21 g/mol, XLogP of 1.14, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(oxolan-2-yl)purine is sourced from PubChem (CID 23184999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).