2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine

C11H20N6 — CID 28913772

IUPAC2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine
SMILESCc1nnc(N2CCN(CCN)CC2)nc1C
InChIInChI=1S/C11H20N6/c1-9-10(2)14-15-11(13-9)17-7-5-16(4-3-12)6-8-17/h3-8,12H2,1-2H3
InChIKeyNOUYLHLSROQZGC-UHFFFAOYSA-N
MW236.32 g/mol
LogP-0.43
Rot. Bonds3

About 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine

2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine (PubChem CID 28913772) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine
PubChem CID28913772
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine
SMILESCc1nnc(N2CCN(CCN)CC2)nc1C
InChIInChI=1S/C11H20N6/c1-9-10(2)14-15-11(13-9)17-7-5-16(4-3-12)6-8-17/h3-8,12H2,1-2H3
InChIKeyNOUYLHLSROQZGC-UHFFFAOYSA-N
XLogP-0.43
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine (CID 28913772) is 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine is Cc1nnc(N2CCN(CCN)CC2)nc1C.
What is the InChIKey of 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine?
The InChIKey is NOUYLHLSROQZGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-9-10(2)14-15-11(13-9)17-7-5-16(4-3-12)6-8-17/h3-8,12H2,1-2H3.
What are the key properties of 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine?
2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine has a molecular weight of 236.32 g/mol, XLogP of -0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)piperazin-1-yl]ethanamine is sourced from PubChem (CID 28913772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).