hydrogen peroxide;2H-tetrazol-5-amine

CH5N5O2 — CID 87704631

IUPAChydrogen peroxide;2H-tetrazol-5-amine
SMILESNc1nn[nH]n1.OO
InChIInChI=1S/CH3N5.H2O2/c2-1-3-5-6-4-1;1-2/h(H3,2,3,4,5,6);1-2H
InChIKeyGCXKUODFIJXWTI-UHFFFAOYSA-N
MW119.08 g/mol
LogP-1.20
Rot. Bonds

About hydrogen peroxide;2H-tetrazol-5-amine

hydrogen peroxide;2H-tetrazol-5-amine (PubChem CID 87704631) has the molecular formula CH5N5O2 and a molecular weight of 119.08 g/mol. Its IUPAC name is hydrogen peroxide;2H-tetrazol-5-amine.

Molecular Properties

Compound Namehydrogen peroxide;2H-tetrazol-5-amine
PubChem CID87704631
Molecular FormulaCH5N5O2
Molecular Weight119.08 g/mol
Exact Mass119.04
IUPAC Namehydrogen peroxide;2H-tetrazol-5-amine
SMILESNc1nn[nH]n1.OO
InChIInChI=1S/CH3N5.H2O2/c2-1-3-5-6-4-1;1-2/h(H3,2,3,4,5,6);1-2H
InChIKeyGCXKUODFIJXWTI-UHFFFAOYSA-N
XLogP-1.20
TPSA120.94 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.08
LogP ≤ 5-1.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

sodium;2H-tetrazol-5-amine;chloride
CID 174904004
sodium;hydride;2H-tetrazol-5-amine
CID 173196739
barium(2+);hydride;2H-tetrazol-5-amine
CID 173021575
CID 174881615
CID 174881615
1H-pyrrole;2H-tetrazol-5-amine
CID 157483039
iron(3+);oxygen(2-);2H-tetrazol-5-amine;nitrate
CID 161287015
bis(2H-tetrazol-5-yl)diazene;guanidine
CID 173025906
methanamine;5-methyl-2H-tetrazole
CID 162293320
2H-tetrazol-5-ylmethanamine
CID 5146781
3,5-diamino-4-(2H-tetrazol-5-yl)benzoic acid
CID 121474244
5-methyl-2H-tetrazole;prop-1-en-2-amine
CID 158635982
(2S)-2-amino-N-(2H-tetrazol-5-yl)butanamide;hydrochloride
CID 130835173

Frequently Asked Questions

What is the IUPAC name of hydrogen peroxide;2H-tetrazol-5-amine?
The IUPAC name of hydrogen peroxide;2H-tetrazol-5-amine (CID 87704631) is hydrogen peroxide;2H-tetrazol-5-amine.
What is the SMILES notation for hydrogen peroxide;2H-tetrazol-5-amine?
The canonical SMILES for hydrogen peroxide;2H-tetrazol-5-amine is Nc1nn[nH]n1.OO.
What is the InChIKey of hydrogen peroxide;2H-tetrazol-5-amine?
The InChIKey is GCXKUODFIJXWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3N5.H2O2/c2-1-3-5-6-4-1;1-2/h(H3,2,3,4,5,6);1-2H.
What are the key properties of hydrogen peroxide;2H-tetrazol-5-amine?
hydrogen peroxide;2H-tetrazol-5-amine has a molecular weight of 119.08 g/mol, XLogP of -1.20, 0 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydrogen peroxide;2H-tetrazol-5-amine is sourced from PubChem (CID 87704631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).