piperazine;triazinane

C7H19N5 — CID 161428593

IUPACpiperazine;triazinane
SMILESC1CNCCN1.C1CNNNC1
InChIInChI=1S/C4H10N2.C3H9N3/c1-2-6-4-3-5-1;1-2-4-6-5-3-1/h5-6H,1-4H2;4-6H,1-3H2
InChIKeyVXRYJXHXFWSMJW-UHFFFAOYSA-N
MW173.26 g/mol
LogP-1.83
Rot. Bonds

About piperazine;triazinane

piperazine;triazinane (PubChem CID 161428593) has the molecular formula C7H19N5 and a molecular weight of 173.26 g/mol. Its IUPAC name is piperazine;triazinane.

Molecular Properties

Compound Namepiperazine;triazinane
PubChem CID161428593
Molecular FormulaC7H19N5
Molecular Weight173.26 g/mol
Exact Mass173.16
IUPAC Namepiperazine;triazinane
SMILESC1CNCCN1.C1CNNNC1
InChIInChI=1S/C4H10N2.C3H9N3/c1-2-6-4-3-5-1;1-2-4-6-5-3-1/h5-6H,1-4H2;4-6H,1-3H2
InChIKeyVXRYJXHXFWSMJW-UHFFFAOYSA-N
XLogP-1.83
TPSA60.15 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 5-1.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Analyze piperazine;triazinane 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

imidazolidine;piperazine;pyrazolidine;triazolidine
CID 158188475
1,4-diazepane;hydrobromide
CID 141400747
methanamine;triazinane
CID 159272795
1,4,8,12-tetrazacyclopentadecane;1,4,8,11-tetrazacyclotetradecane;1,4,7,10-tetrazacyclotridecane
CID 23302195
1,4,7,10-tetrazacyclotridecane
CID 11478723
1,5,9-triazacyclododecane;hydrobromide
CID 45051876
1,4,8,11-tetrazacyclotetradecane;1,4,7-triazonane
CID 159801771
cobalt;1,4,8,11-tetrazacyclotetradecane
CID 67843404
1,4-diazepane;dihydrochloride
CID 23441047
copper 1,4,8,11-tetrazacyclotetradecane
CID 11966228
1,5,9,13,17-pentazacycloicosane
CID 20533697
1,4,7,10,13,16,19,22-octazacyclotetracosane
CID 6395032

Frequently Asked Questions

What is the IUPAC name of piperazine;triazinane?
The IUPAC name of piperazine;triazinane (CID 161428593) is piperazine;triazinane.
What is the SMILES notation for piperazine;triazinane?
The canonical SMILES for piperazine;triazinane is C1CNCCN1.C1CNNNC1.
What is the InChIKey of piperazine;triazinane?
The InChIKey is VXRYJXHXFWSMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2.C3H9N3/c1-2-6-4-3-5-1;1-2-4-6-5-3-1/h5-6H,1-4H2;4-6H,1-3H2.
What are the key properties of piperazine;triazinane?
piperazine;triazinane has a molecular weight of 173.26 g/mol, XLogP of -1.83, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperazine;triazinane is sourced from PubChem (CID 161428593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).