N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine

C9H16N6 — CID 22966752

IUPACN,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(C)nc(N2CCNCC2)n1
InChIInChI=1S/C9H16N6/c1-7-12-8(10-2)14-9(13-7)15-5-3-11-4-6-15/h11H,3-6H2,1-2H3,(H,10,12,13,14)
InChIKeyIEESMQGVPOOLQI-UHFFFAOYSA-N
MW208.27 g/mol
LogP-0.37
Rot. Bonds2

About N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine

N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine (PubChem CID 22966752) has the molecular formula C9H16N6 and a molecular weight of 208.27 g/mol. Its IUPAC name is N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine
PubChem CID22966752
Molecular FormulaC9H16N6
Molecular Weight208.27 g/mol
Exact Mass208.14
IUPAC NameN,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(C)nc(N2CCNCC2)n1
InChIInChI=1S/C9H16N6/c1-7-12-8(10-2)14-9(13-7)15-5-3-11-4-6-15/h11H,3-6H2,1-2H3,(H,10,12,13,14)
InChIKeyIEESMQGVPOOLQI-UHFFFAOYSA-N
XLogP-0.37
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine (CID 22966752) is N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine is CNc1nc(C)nc(N2CCNCC2)n1.
What is the InChIKey of N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is IEESMQGVPOOLQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6/c1-7-12-8(10-2)14-9(13-7)15-5-3-11-4-6-15/h11H,3-6H2,1-2H3,(H,10,12,13,14).
What are the key properties of N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine?
N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 208.27 g/mol, XLogP of -0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-6-piperazin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 22966752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).