9-ethylpurin-6-amine

C7H9N5 — CID 7

IUPAC9-ethylpurin-6-amine
SMILESCCn1cnc2c(N)ncnc21
InChIInChI=1S/C7H9N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h3-4H,2H2,1H3,(H2,8,9,10)
InChIKeyMUIPLRMGAXZWSQ-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.43
Rot. Bonds1

About 9-ethylpurin-6-amine

9-ethylpurin-6-amine (PubChem CID 7) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 9-ethylpurin-6-amine.

Molecular Properties

Compound Name9-ethylpurin-6-amine
PubChem CID7
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name9-ethylpurin-6-amine
SMILESCCn1cnc2c(N)ncnc21
InChIInChI=1S/C7H9N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h3-4H,2H2,1H3,(H2,8,9,10)
InChIKeyMUIPLRMGAXZWSQ-UHFFFAOYSA-N
XLogP0.43
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 9-ethylpurin-6-amine 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-ethylpurin-6-amine?
The IUPAC name of 9-ethylpurin-6-amine (CID 7) is 9-ethylpurin-6-amine.
What is the SMILES notation for 9-ethylpurin-6-amine?
The canonical SMILES for 9-ethylpurin-6-amine is CCn1cnc2c(N)ncnc21.
What is the InChIKey of 9-ethylpurin-6-amine?
The InChIKey is MUIPLRMGAXZWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h3-4H,2H2,1H3,(H2,8,9,10).
What are the key properties of 9-ethylpurin-6-amine?
9-ethylpurin-6-amine has a molecular weight of 163.18 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethylpurin-6-amine is sourced from PubChem (CID 7), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).