2,2-bis(2H-tetrazol-5-yl)piperazine

C6H10N10 — CID 70150155

IUPAC2,2-bis(2H-tetrazol-5-yl)piperazine
SMILESC1CNC(c2nn[nH]n2)(c2nn[nH]n2)CN1
InChIInChI=1S/C6H10N10/c1-2-8-6(3-7-1,4-9-13-14-10-4)5-11-15-16-12-5/h7-8H,1-3H2,(H,9,10,13,14)(H,11,12,15,16)
InChIKeyWCODDSJQCPCNDA-UHFFFAOYSA-N
MW222.22 g/mol
LogP-2.85
Rot. Bonds2

About 2,2-bis(2H-tetrazol-5-yl)piperazine

2,2-bis(2H-tetrazol-5-yl)piperazine (PubChem CID 70150155) has the molecular formula C6H10N10 and a molecular weight of 222.22 g/mol. Its IUPAC name is 2,2-bis(2H-tetrazol-5-yl)piperazine.

Molecular Properties

Compound Name2,2-bis(2H-tetrazol-5-yl)piperazine
PubChem CID70150155
Molecular FormulaC6H10N10
Molecular Weight222.22 g/mol
Exact Mass222.11
IUPAC Name2,2-bis(2H-tetrazol-5-yl)piperazine
SMILESC1CNC(c2nn[nH]n2)(c2nn[nH]n2)CN1
InChIInChI=1S/C6H10N10/c1-2-8-6(3-7-1,4-9-13-14-10-4)5-11-15-16-12-5/h7-8H,1-3H2,(H,9,10,13,14)(H,11,12,15,16)
InChIKeyWCODDSJQCPCNDA-UHFFFAOYSA-N
XLogP-2.85
TPSA132.98 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 5-2.85
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2H-tetrazol-5-yl)piperazine?
The IUPAC name of 2,2-bis(2H-tetrazol-5-yl)piperazine (CID 70150155) is 2,2-bis(2H-tetrazol-5-yl)piperazine.
What is the SMILES notation for 2,2-bis(2H-tetrazol-5-yl)piperazine?
The canonical SMILES for 2,2-bis(2H-tetrazol-5-yl)piperazine is C1CNC(c2nn[nH]n2)(c2nn[nH]n2)CN1.
What is the InChIKey of 2,2-bis(2H-tetrazol-5-yl)piperazine?
The InChIKey is WCODDSJQCPCNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N10/c1-2-8-6(3-7-1,4-9-13-14-10-4)5-11-15-16-12-5/h7-8H,1-3H2,(H,9,10,13,14)(H,11,12,15,16).
What are the key properties of 2,2-bis(2H-tetrazol-5-yl)piperazine?
2,2-bis(2H-tetrazol-5-yl)piperazine has a molecular weight of 222.22 g/mol, XLogP of -2.85, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2H-tetrazol-5-yl)piperazine is sourced from PubChem (CID 70150155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).