2-piperazin-1-yl-1,3,5-triazine

C7H11N5 — CID 2760673

IUPAC2-piperazin-1-yl-1,3,5-triazine
SMILESc1ncnc(N2CCNCC2)n1
InChIInChI=1S/C7H11N5/c1-3-12(4-2-8-1)7-10-5-9-6-11-7/h5-6,8H,1-4H2
InChIKeyQKOFSFOOALTCPW-UHFFFAOYSA-N
MW165.20 g/mol
LogP-0.72
Rot. Bonds1

About 2-piperazin-1-yl-1,3,5-triazine

2-piperazin-1-yl-1,3,5-triazine (PubChem CID 2760673) has the molecular formula C7H11N5 and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-piperazin-1-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-piperazin-1-yl-1,3,5-triazine
PubChem CID2760673
Molecular FormulaC7H11N5
Molecular Weight165.20 g/mol
Exact Mass165.10
IUPAC Name2-piperazin-1-yl-1,3,5-triazine
SMILESc1ncnc(N2CCNCC2)n1
InChIInChI=1S/C7H11N5/c1-3-12(4-2-8-1)7-10-5-9-6-11-7/h5-6,8H,1-4H2
InChIKeyQKOFSFOOALTCPW-UHFFFAOYSA-N
XLogP-0.72
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-piperazin-1-yl-1,3,5-triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-4-piperazin-1-yl-1,3,5-triazine
CID 54357139
butane;2-piperazin-1-ylpyrimidine
CID 144912345
5-bromo-2-piperazin-1-ylpyrimidine;ethane
CID 143817069
2-[2-[[4-piperazin-1-yl-6-[4-(1,3,5-triazin-2-yl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethoxy]ethanol
CID 102513900
2-piperazin-1-yl-5-propan-2-ylpyrimidine
CID 103278323
5-methyl-2-piperazin-1-ylpyrimidine;2-methylpropane
CID 145233053
2-(piperazin-1-ylmethyl)-1,3,5-triazine
CID 82468295
heptane;2-piperazin-1-ylpyrimidine
CID 144585904
5-(2,2-dimethylpropyl)-2-piperazin-1-ylpyrimidine
CID 117224212
5-iodo-4-piperazin-1-ylpyrimidine;dihydrochloride
CID 67539377
3,6-di(piperazin-1-yl)-1,2,4-triazine
CID 129162608
5-piperazin-1-ylpyrimidine;hydrochloride
CID 69201469

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-1,3,5-triazine?
The IUPAC name of 2-piperazin-1-yl-1,3,5-triazine (CID 2760673) is 2-piperazin-1-yl-1,3,5-triazine.
What is the SMILES notation for 2-piperazin-1-yl-1,3,5-triazine?
The canonical SMILES for 2-piperazin-1-yl-1,3,5-triazine is c1ncnc(N2CCNCC2)n1.
What is the InChIKey of 2-piperazin-1-yl-1,3,5-triazine?
The InChIKey is QKOFSFOOALTCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5/c1-3-12(4-2-8-1)7-10-5-9-6-11-7/h5-6,8H,1-4H2.
What are the key properties of 2-piperazin-1-yl-1,3,5-triazine?
2-piperazin-1-yl-1,3,5-triazine has a molecular weight of 165.20 g/mol, XLogP of -0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-1,3,5-triazine is sourced from PubChem (CID 2760673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).