bis(2H-tetrazol-5-yl)diazene;guanidine

C3H7N13 — CID 173025906

IUPACbis(2H-tetrazol-5-yl)diazene;guanidine
SMILESN(=Nc1nn[nH]n1)c1nn[nH]n1.[H]N=C(N)N
InChIInChI=1S/C2H2N10.CH5N3/c3(1-5-9-10-6-1)4-2-7-11-12-8-2;2-1(3)4/h(H,5,6,9,10)(H,7,8,11,12);(H5,2,3,4)
InChIKeyKSQFRMPOEJCKIY-UHFFFAOYSA-N
MW225.18 g/mol
LogP-2.03
Rot. Bonds2

About bis(2H-tetrazol-5-yl)diazene;guanidine

bis(2H-tetrazol-5-yl)diazene;guanidine (PubChem CID 173025906) has the molecular formula C3H7N13 and a molecular weight of 225.18 g/mol. Its IUPAC name is bis(2H-tetrazol-5-yl)diazene;guanidine.

Molecular Properties

Compound Namebis(2H-tetrazol-5-yl)diazene;guanidine
PubChem CID173025906
Molecular FormulaC3H7N13
Molecular Weight225.18 g/mol
Exact Mass225.09
IUPAC Namebis(2H-tetrazol-5-yl)diazene;guanidine
SMILESN(=Nc1nn[nH]n1)c1nn[nH]n1.[H]N=C(N)N
InChIInChI=1S/C2H2N10.CH5N3/c3(1-5-9-10-6-1)4-2-7-11-12-8-2;2-1(3)4/h(H,5,6,9,10)(H,7,8,11,12);(H5,2,3,4)
InChIKeyKSQFRMPOEJCKIY-UHFFFAOYSA-N
XLogP-2.03
TPSA209.53 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.18
LogP ≤ 5-2.03
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

[(E)-2H-tetrazol-5-yldiazenyl]methanol
CID 137267834
1-N,4-N-bis(2H-tetrazol-5-yl)benzene-1,4-dicarboximidate
CID 2245163
N-methyl-N-(2H-tetrazol-5-yldiazenyl)aniline
CID 137190281
hydrogen peroxide;2H-tetrazol-5-amine
CID 87704631
(4-methoxyphenyl)methyl-(2H-tetrazol-5-yl)diazene
CID 170922069
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CID 136600638
ethyl 2-[(E)-2H-tetrazol-5-yldiazenyl]-2-[(E)-1H-1,2,4-triazol-5-yldiazenyl]acetate
CID 135614157
5-bromo-3-(2H-tetrazol-5-yldiazenyl)-1H-indol-2-olate
CID 135591556
1-N,3-N-bis(2H-tetrazol-5-yl)isoindole-1,3-diimine
CID 135820736
1-(2H-tetrazol-5-yl)butan-1-ol
CID 69249194
3,3-diphenyl-N-(2H-tetrazol-5-yl)propanimidate
CID 2166727
4-tert-butyl-N-(2H-tetrazol-5-yl)benzenecarboximidate
CID 4744985

Frequently Asked Questions

What is the IUPAC name of bis(2H-tetrazol-5-yl)diazene;guanidine?
The IUPAC name of bis(2H-tetrazol-5-yl)diazene;guanidine (CID 173025906) is bis(2H-tetrazol-5-yl)diazene;guanidine.
What is the SMILES notation for bis(2H-tetrazol-5-yl)diazene;guanidine?
The canonical SMILES for bis(2H-tetrazol-5-yl)diazene;guanidine is N(=Nc1nn[nH]n1)c1nn[nH]n1.[H]N=C(N)N.
What is the InChIKey of bis(2H-tetrazol-5-yl)diazene;guanidine?
The InChIKey is KSQFRMPOEJCKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N10.CH5N3/c3(1-5-9-10-6-1)4-2-7-11-12-8-2;2-1(3)4/h(H,5,6,9,10)(H,7,8,11,12);(H5,2,3,4).
What are the key properties of bis(2H-tetrazol-5-yl)diazene;guanidine?
bis(2H-tetrazol-5-yl)diazene;guanidine has a molecular weight of 225.18 g/mol, XLogP of -2.03, 2 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2H-tetrazol-5-yl)diazene;guanidine is sourced from PubChem (CID 173025906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).