9-ethyl-8-(furan-2-yl)purin-6-amine

C11H11N5O — CID 11229946

IUPAC9-ethyl-8-(furan-2-yl)purin-6-amine
SMILESCCn1c(-c2ccco2)nc2c(N)ncnc21
InChIInChI=1S/C11H11N5O/c1-2-16-10(7-4-3-5-17-7)15-8-9(12)13-6-14-11(8)16/h3-6H,2H2,1H3,(H2,12,13,14)
InChIKeySUGBMFVITGLGIX-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.69
Rot. Bonds2

About 9-ethyl-8-(furan-2-yl)purin-6-amine

9-ethyl-8-(furan-2-yl)purin-6-amine (PubChem CID 11229946) has the molecular formula C11H11N5O and a molecular weight of 229.24 g/mol. Its IUPAC name is 9-ethyl-8-(furan-2-yl)purin-6-amine.

Molecular Properties

Compound Name9-ethyl-8-(furan-2-yl)purin-6-amine
PubChem CID11229946
Molecular FormulaC11H11N5O
Molecular Weight229.24 g/mol
Exact Mass229.10
IUPAC Name9-ethyl-8-(furan-2-yl)purin-6-amine
SMILESCCn1c(-c2ccco2)nc2c(N)ncnc21
InChIInChI=1S/C11H11N5O/c1-2-16-10(7-4-3-5-17-7)15-8-9(12)13-6-14-11(8)16/h3-6H,2H2,1H3,(H2,12,13,14)
InChIKeySUGBMFVITGLGIX-UHFFFAOYSA-N
XLogP1.69
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 9-ethyl-8-(furan-2-yl)purin-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-ethyl-8-(furan-2-yl)purin-6-amine?
The IUPAC name of 9-ethyl-8-(furan-2-yl)purin-6-amine (CID 11229946) is 9-ethyl-8-(furan-2-yl)purin-6-amine.
What is the SMILES notation for 9-ethyl-8-(furan-2-yl)purin-6-amine?
The canonical SMILES for 9-ethyl-8-(furan-2-yl)purin-6-amine is CCn1c(-c2ccco2)nc2c(N)ncnc21.
What is the InChIKey of 9-ethyl-8-(furan-2-yl)purin-6-amine?
The InChIKey is SUGBMFVITGLGIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O/c1-2-16-10(7-4-3-5-17-7)15-8-9(12)13-6-14-11(8)16/h3-6H,2H2,1H3,(H2,12,13,14).
What are the key properties of 9-ethyl-8-(furan-2-yl)purin-6-amine?
9-ethyl-8-(furan-2-yl)purin-6-amine has a molecular weight of 229.24 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-8-(furan-2-yl)purin-6-amine is sourced from PubChem (CID 11229946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).