tetrazol-1-ylmethanamine;hydrochloride

C2H6ClN5 — CID 172738284

IUPACtetrazol-1-ylmethanamine;hydrochloride
SMILESCl.NCn1cnnn1
InChIInChI=1S/C2H5N5.ClH/c3-1-7-2-4-5-6-7;/h2H,1,3H2;1H
InChIKeyISYSWRJHOBQSGT-UHFFFAOYSA-N
MW135.56 g/mol
LogP-0.99
Rot. Bonds1

About tetrazol-1-ylmethanamine;hydrochloride

tetrazol-1-ylmethanamine;hydrochloride (PubChem CID 172738284) has the molecular formula C2H6ClN5 and a molecular weight of 135.56 g/mol. Its IUPAC name is tetrazol-1-ylmethanamine;hydrochloride.

Molecular Properties

Compound Nametetrazol-1-ylmethanamine;hydrochloride
PubChem CID172738284
Molecular FormulaC2H6ClN5
Molecular Weight135.56 g/mol
Exact Mass135.03
IUPAC Nametetrazol-1-ylmethanamine;hydrochloride
SMILESCl.NCn1cnnn1
InChIInChI=1S/C2H5N5.ClH/c3-1-7-2-4-5-6-7;/h2H,1,3H2;1H
InChIKeyISYSWRJHOBQSGT-UHFFFAOYSA-N
XLogP-0.99
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.56
LogP ≤ 5-0.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of tetrazol-1-ylmethanamine;hydrochloride?
The IUPAC name of tetrazol-1-ylmethanamine;hydrochloride (CID 172738284) is tetrazol-1-ylmethanamine;hydrochloride.
What is the SMILES notation for tetrazol-1-ylmethanamine;hydrochloride?
The canonical SMILES for tetrazol-1-ylmethanamine;hydrochloride is Cl.NCn1cnnn1.
What is the InChIKey of tetrazol-1-ylmethanamine;hydrochloride?
The InChIKey is ISYSWRJHOBQSGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N5.ClH/c3-1-7-2-4-5-6-7;/h2H,1,3H2;1H.
What are the key properties of tetrazol-1-ylmethanamine;hydrochloride?
tetrazol-1-ylmethanamine;hydrochloride has a molecular weight of 135.56 g/mol, XLogP of -0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tetrazol-1-ylmethanamine;hydrochloride is sourced from PubChem (CID 172738284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).