2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine

C8H8N6 — CID 140921038

IUPAC2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine
SMILESNc1cnc(-c2ncc(N)cn2)nc1
InChIInChI=1S/C8H8N6/c9-5-1-11-7(12-2-5)8-13-3-6(10)4-14-8/h1-4H,9-10H2
InChIKeyZMZDWBLXJRGQFF-UHFFFAOYSA-N
MW188.19 g/mol
LogP0.10
Rot. Bonds1

About 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine

2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine (PubChem CID 140921038) has the molecular formula C8H8N6 and a molecular weight of 188.19 g/mol. Its IUPAC name is 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine.

Molecular Properties

Compound Name2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine
PubChem CID140921038
Molecular FormulaC8H8N6
Molecular Weight188.19 g/mol
Exact Mass188.08
IUPAC Name2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine
SMILESNc1cnc(-c2ncc(N)cn2)nc1
InChIInChI=1S/C8H8N6/c9-5-1-11-7(12-2-5)8-13-3-6(10)4-14-8/h1-4H,9-10H2
InChIKeyZMZDWBLXJRGQFF-UHFFFAOYSA-N
XLogP0.10
TPSA103.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine?
The IUPAC name of 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine (CID 140921038) is 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine.
What is the SMILES notation for 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine?
The canonical SMILES for 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine is Nc1cnc(-c2ncc(N)cn2)nc1.
What is the InChIKey of 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine?
The InChIKey is ZMZDWBLXJRGQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N6/c9-5-1-11-7(12-2-5)8-13-3-6(10)4-14-8/h1-4H,9-10H2.
What are the key properties of 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine?
2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine has a molecular weight of 188.19 g/mol, XLogP of 0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminopyrimidin-2-yl)pyrimidin-5-amine is sourced from PubChem (CID 140921038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).