N-pyrazin-2-yl-1,2,4-triazin-3-amine

C7H6N6 — CID 11298241

IUPACN-pyrazin-2-yl-1,2,4-triazin-3-amine
SMILESc1cnc(Nc2nccnn2)cn1
InChIInChI=1S/C7H6N6/c1-2-9-6(5-8-1)12-7-10-3-4-11-13-7/h1-5H,(H,9,10,12,13)
InChIKeyDDTXGXZBWZZDFW-UHFFFAOYSA-N
MW174.17 g/mol
LogP0.41
Rot. Bonds2

About N-pyrazin-2-yl-1,2,4-triazin-3-amine

N-pyrazin-2-yl-1,2,4-triazin-3-amine (PubChem CID 11298241) has the molecular formula C7H6N6 and a molecular weight of 174.17 g/mol. Its IUPAC name is N-pyrazin-2-yl-1,2,4-triazin-3-amine.

Molecular Properties

Compound NameN-pyrazin-2-yl-1,2,4-triazin-3-amine
PubChem CID11298241
Molecular FormulaC7H6N6
Molecular Weight174.17 g/mol
Exact Mass174.07
IUPAC NameN-pyrazin-2-yl-1,2,4-triazin-3-amine
SMILESc1cnc(Nc2nccnn2)cn1
InChIInChI=1S/C7H6N6/c1-2-9-6(5-8-1)12-7-10-3-4-11-13-7/h1-5H,(H,9,10,12,13)
InChIKeyDDTXGXZBWZZDFW-UHFFFAOYSA-N
XLogP0.41
TPSA76.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.17
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-pyrazin-2-yl-1,2,4-triazin-3-amine?
The IUPAC name of N-pyrazin-2-yl-1,2,4-triazin-3-amine (CID 11298241) is N-pyrazin-2-yl-1,2,4-triazin-3-amine.
What is the SMILES notation for N-pyrazin-2-yl-1,2,4-triazin-3-amine?
The canonical SMILES for N-pyrazin-2-yl-1,2,4-triazin-3-amine is c1cnc(Nc2nccnn2)cn1.
What is the InChIKey of N-pyrazin-2-yl-1,2,4-triazin-3-amine?
The InChIKey is DDTXGXZBWZZDFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N6/c1-2-9-6(5-8-1)12-7-10-3-4-11-13-7/h1-5H,(H,9,10,12,13).
What are the key properties of N-pyrazin-2-yl-1,2,4-triazin-3-amine?
N-pyrazin-2-yl-1,2,4-triazin-3-amine has a molecular weight of 174.17 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazin-2-yl-1,2,4-triazin-3-amine is sourced from PubChem (CID 11298241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).