7H-purin-6-amine;7H-purine

C10H9N9 — CID 22323795

IUPAC7H-purin-6-amine;7H-purine
SMILESNc1ncnc2nc[nH]c12.c1ncc2[nH]cnc2n1
InChIInChI=1S/C5H5N5.C5H4N4/c6-4-3-5(9-1-7-3)10-2-8-4;1-4-5(8-2-6-1)9-3-7-4/h1-2H,(H3,6,7,8,9,10);1-3H,(H,6,7,8,9)
InChIKeyAXXVSCRPHPIDIW-UHFFFAOYSA-N
MW255.25 g/mol
LogP0.29
Rot. Bonds

About 7H-purin-6-amine;7H-purine

7H-purin-6-amine;7H-purine (PubChem CID 22323795) has the molecular formula C10H9N9 and a molecular weight of 255.25 g/mol. Its IUPAC name is 7H-purin-6-amine;7H-purine.

Molecular Properties

Compound Name7H-purin-6-amine;7H-purine
PubChem CID22323795
Molecular FormulaC10H9N9
Molecular Weight255.25 g/mol
Exact Mass255.10
IUPAC Name7H-purin-6-amine;7H-purine
SMILESNc1ncnc2nc[nH]c12.c1ncc2[nH]cnc2n1
InChIInChI=1S/C5H5N5.C5H4N4/c6-4-3-5(9-1-7-3)10-2-8-4;1-4-5(8-2-6-1)9-3-7-4/h1-2H,(H3,6,7,8,9,10);1-3H,(H,6,7,8,9)
InChIKeyAXXVSCRPHPIDIW-UHFFFAOYSA-N
XLogP0.29
TPSA134.94 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7H-purin-6-amine;7H-purine?
The IUPAC name of 7H-purin-6-amine;7H-purine (CID 22323795) is 7H-purin-6-amine;7H-purine.
What is the SMILES notation for 7H-purin-6-amine;7H-purine?
The canonical SMILES for 7H-purin-6-amine;7H-purine is Nc1ncnc2nc[nH]c12.c1ncc2[nH]cnc2n1.
What is the InChIKey of 7H-purin-6-amine;7H-purine?
The InChIKey is AXXVSCRPHPIDIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5.C5H4N4/c6-4-3-5(9-1-7-3)10-2-8-4;1-4-5(8-2-6-1)9-3-7-4/h1-2H,(H3,6,7,8,9,10);1-3H,(H,6,7,8,9).
What are the key properties of 7H-purin-6-amine;7H-purine?
7H-purin-6-amine;7H-purine has a molecular weight of 255.25 g/mol, XLogP of 0.29, 0 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-purin-6-amine;7H-purine is sourced from PubChem (CID 22323795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).