barium(2+);hydride;2H-tetrazol-5-amine

CH5BaN5 — CID 173021575

IUPACbarium(2+);hydride;2H-tetrazol-5-amine
SMILESNc1nn[nH]n1.[Ba+2].[H-].[H-]
InChIInChI=1S/CH3N5.Ba.2H/c2-1-3-5-6-4-1;;;/h(H3,2,3,4,5,6);;;/q;+2;2*-1
InChIKeyIPFDHHDXPVRLJJ-UHFFFAOYSA-N
MW224.41 g/mol
LogP-1.37
Rot. Bonds

About barium(2+);hydride;2H-tetrazol-5-amine

barium(2+);hydride;2H-tetrazol-5-amine (PubChem CID 173021575) has the molecular formula CH5BaN5 and a molecular weight of 224.41 g/mol. Its IUPAC name is barium(2+);hydride;2H-tetrazol-5-amine.

Molecular Properties

Compound Namebarium(2+);hydride;2H-tetrazol-5-amine
PubChem CID173021575
Molecular FormulaCH5BaN5
Molecular Weight224.41 g/mol
Exact Mass224.96
IUPAC Namebarium(2+);hydride;2H-tetrazol-5-amine
SMILESNc1nn[nH]n1.[Ba+2].[H-].[H-]
InChIInChI=1S/CH3N5.Ba.2H/c2-1-3-5-6-4-1;;;/h(H3,2,3,4,5,6);;;/q;+2;2*-1
InChIKeyIPFDHHDXPVRLJJ-UHFFFAOYSA-N
XLogP-1.37
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.41
LogP ≤ 5-1.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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methanamine;5-methyl-2H-tetrazole
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2-[amino(2H-tetrazol-5-yl)amino]ethanol;barium(2+);hydride
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2,4-dichloro-6-methoxy-1,3,5-triazine;1-(4,6-dimethoxy-1,3,5-triazin-2-yl)tetrazol-5-amine;2H-tetrazol-5-amine
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Frequently Asked Questions

What is the IUPAC name of barium(2+);hydride;2H-tetrazol-5-amine?
The IUPAC name of barium(2+);hydride;2H-tetrazol-5-amine (CID 173021575) is barium(2+);hydride;2H-tetrazol-5-amine.
What is the SMILES notation for barium(2+);hydride;2H-tetrazol-5-amine?
The canonical SMILES for barium(2+);hydride;2H-tetrazol-5-amine is Nc1nn[nH]n1.[Ba+2].[H-].[H-].
What is the InChIKey of barium(2+);hydride;2H-tetrazol-5-amine?
The InChIKey is IPFDHHDXPVRLJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3N5.Ba.2H/c2-1-3-5-6-4-1;;;/h(H3,2,3,4,5,6);;;/q;+2;2*-1.
What are the key properties of barium(2+);hydride;2H-tetrazol-5-amine?
barium(2+);hydride;2H-tetrazol-5-amine has a molecular weight of 224.41 g/mol, XLogP of -1.37, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);hydride;2H-tetrazol-5-amine is sourced from PubChem (CID 173021575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).