2-methoxy-7H-purin-6-amine

C6H7N5O — CID 5194506

IUPAC2-methoxy-7H-purin-6-amine
SMILESCOc1nc(N)c2[nH]cnc2n1
InChIInChI=1S/C6H7N5O/c1-12-6-10-4(7)3-5(11-6)9-2-8-3/h2H,1H3,(H3,7,8,9,10,11)
InChIKeyTUDKBZAMOFJOSO-UHFFFAOYSA-N
MW165.16 g/mol
LogP-0.06
Rot. Bonds1

About 2-methoxy-7H-purin-6-amine

2-methoxy-7H-purin-6-amine (PubChem CID 5194506) has the molecular formula C6H7N5O and a molecular weight of 165.16 g/mol. Its IUPAC name is 2-methoxy-7H-purin-6-amine.

Molecular Properties

Compound Name2-methoxy-7H-purin-6-amine
PubChem CID5194506
Molecular FormulaC6H7N5O
Molecular Weight165.16 g/mol
Exact Mass165.07
IUPAC Name2-methoxy-7H-purin-6-amine
SMILESCOc1nc(N)c2[nH]cnc2n1
InChIInChI=1S/C6H7N5O/c1-12-6-10-4(7)3-5(11-6)9-2-8-3/h2H,1H3,(H3,7,8,9,10,11)
InChIKeyTUDKBZAMOFJOSO-UHFFFAOYSA-N
XLogP-0.06
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-7H-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 2-methoxy-7H-purin-6-amine?
The IUPAC name of 2-methoxy-7H-purin-6-amine (CID 5194506) is 2-methoxy-7H-purin-6-amine.
What is the SMILES notation for 2-methoxy-7H-purin-6-amine?
The canonical SMILES for 2-methoxy-7H-purin-6-amine is COc1nc(N)c2[nH]cnc2n1.
What is the InChIKey of 2-methoxy-7H-purin-6-amine?
The InChIKey is TUDKBZAMOFJOSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N5O/c1-12-6-10-4(7)3-5(11-6)9-2-8-3/h2H,1H3,(H3,7,8,9,10,11).
What are the key properties of 2-methoxy-7H-purin-6-amine?
2-methoxy-7H-purin-6-amine has a molecular weight of 165.16 g/mol, XLogP of -0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-7H-purin-6-amine is sourced from PubChem (CID 5194506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).