N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine

C2H5N9 — CID 163659393

IUPACN-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine
SMILESN1=NC(Nc2nn[nH]n2)NN1
InChIInChI=1S/C2H5N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h1H,(H,4,9)(H,5,8)(H2,3,6,7,10,11)
InChIKeyITBUINMDSTWCBX-UHFFFAOYSA-N
MW155.12 g/mol
LogP-1.63
Rot. Bonds2

About N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine

N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine (PubChem CID 163659393) has the molecular formula C2H5N9 and a molecular weight of 155.12 g/mol. Its IUPAC name is N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine.

Molecular Properties

Compound NameN-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine
PubChem CID163659393
Molecular FormulaC2H5N9
Molecular Weight155.12 g/mol
Exact Mass155.07
IUPAC NameN-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine
SMILESN1=NC(Nc2nn[nH]n2)NN1
InChIInChI=1S/C2H5N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h1H,(H,4,9)(H,5,8)(H2,3,6,7,10,11)
InChIKeyITBUINMDSTWCBX-UHFFFAOYSA-N
XLogP-1.63
TPSA115.27 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.12
LogP ≤ 5-1.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine?
The IUPAC name of N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine (CID 163659393) is N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine.
What is the SMILES notation for N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine?
The canonical SMILES for N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine is N1=NC(Nc2nn[nH]n2)NN1.
What is the InChIKey of N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine?
The InChIKey is ITBUINMDSTWCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N9/c3(1-4-8-9-5-1)2-6-10-11-7-2/h1H,(H,4,9)(H,5,8)(H2,3,6,7,10,11).
What are the key properties of N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine?
N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine has a molecular weight of 155.12 g/mol, XLogP of -1.63, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dihydro-1H-tetrazol-5-yl)-2H-tetrazol-5-amine is sourced from PubChem (CID 163659393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).