6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine

C10H15N5 — CID 67768063

IUPAC6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine
SMILESNc1nc(N)nc(C23CCC(CC2)C3)n1
InChIInChI=1S/C10H15N5/c11-8-13-7(14-9(12)15-8)10-3-1-6(5-10)2-4-10/h6H,1-5H2,(H4,11,12,13,14,15)
InChIKeyZIZIHMYXJHGOQT-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.87
Rot. Bonds1

About 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine

6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine (PubChem CID 67768063) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine
PubChem CID67768063
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine
SMILESNc1nc(N)nc(C23CCC(CC2)C3)n1
InChIInChI=1S/C10H15N5/c11-8-13-7(14-9(12)15-8)10-3-1-6(5-10)2-4-10/h6H,1-5H2,(H4,11,12,13,14,15)
InChIKeyZIZIHMYXJHGOQT-UHFFFAOYSA-N
XLogP0.87
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine (CID 67768063) is 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine is Nc1nc(N)nc(C23CCC(CC2)C3)n1.
What is the InChIKey of 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is ZIZIHMYXJHGOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c11-8-13-7(14-9(12)15-8)10-3-1-6(5-10)2-4-10/h6H,1-5H2,(H4,11,12,13,14,15).
What are the key properties of 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine?
6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 205.26 g/mol, XLogP of 0.87, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-bicyclo[2.2.1]heptanyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 67768063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).