bis(2H-tetrazol-5-yl)azanide

C2H2N9- — CID 136738403

IUPACbis(2H-tetrazol-5-yl)azanide
SMILESn1nc([N-]c2nn[nH]n2)n[nH]1
InChIInChI=1S/C2H2N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h(H2-,3,4,5,6,7,8,9,10,11)/q-1
InChIKeyGGJOISTZBBKCNM-UHFFFAOYSA-N
MW152.10 g/mol
LogP-0.95
Rot. Bonds2

About bis(2H-tetrazol-5-yl)azanide

bis(2H-tetrazol-5-yl)azanide (PubChem CID 136738403) has the molecular formula C2H2N9- and a molecular weight of 152.10 g/mol. Its IUPAC name is bis(2H-tetrazol-5-yl)azanide.

Molecular Properties

Compound Namebis(2H-tetrazol-5-yl)azanide
PubChem CID136738403
Molecular FormulaC2H2N9-
Molecular Weight152.10 g/mol
Exact Mass152.04
IUPAC Namebis(2H-tetrazol-5-yl)azanide
SMILESn1nc([N-]c2nn[nH]n2)n[nH]1
InChIInChI=1S/C2H2N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h(H2-,3,4,5,6,7,8,9,10,11)/q-1
InChIKeyGGJOISTZBBKCNM-UHFFFAOYSA-N
XLogP-0.95
TPSA123.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.10
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of bis(2H-tetrazol-5-yl)azanide?
The IUPAC name of bis(2H-tetrazol-5-yl)azanide (CID 136738403) is bis(2H-tetrazol-5-yl)azanide.
What is the SMILES notation for bis(2H-tetrazol-5-yl)azanide?
The canonical SMILES for bis(2H-tetrazol-5-yl)azanide is n1nc([N-]c2nn[nH]n2)n[nH]1.
What is the InChIKey of bis(2H-tetrazol-5-yl)azanide?
The InChIKey is GGJOISTZBBKCNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h(H2-,3,4,5,6,7,8,9,10,11)/q-1.
What are the key properties of bis(2H-tetrazol-5-yl)azanide?
bis(2H-tetrazol-5-yl)azanide has a molecular weight of 152.10 g/mol, XLogP of -0.95, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2H-tetrazol-5-yl)azanide is sourced from PubChem (CID 136738403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).