oxan-2-ylmethylhydrazine;hydrochloride

C6H15ClN2O — CID 121215429

IUPACoxan-2-ylmethylhydrazine;hydrochloride
SMILESCl.NNCC1CCCCO1
InChIInChI=1S/C6H14N2O.ClH/c7-8-5-6-3-1-2-4-9-6;/h6,8H,1-5,7H2;1H
InChIKeyPBZGQLYBZMXAIH-UHFFFAOYSA-N
MW166.65 g/mol
LogP0.44
Rot. Bonds2

About oxan-2-ylmethylhydrazine;hydrochloride

oxan-2-ylmethylhydrazine;hydrochloride (PubChem CID 121215429) has the molecular formula C6H15ClN2O and a molecular weight of 166.65 g/mol. Its IUPAC name is oxan-2-ylmethylhydrazine;hydrochloride.

Molecular Properties

Compound Nameoxan-2-ylmethylhydrazine;hydrochloride
PubChem CID121215429
Molecular FormulaC6H15ClN2O
Molecular Weight166.65 g/mol
Exact Mass166.09
IUPAC Nameoxan-2-ylmethylhydrazine;hydrochloride
SMILESCl.NNCC1CCCCO1
InChIInChI=1S/C6H14N2O.ClH/c7-8-5-6-3-1-2-4-9-6;/h6,8H,1-5,7H2;1H
InChIKeyPBZGQLYBZMXAIH-UHFFFAOYSA-N
XLogP0.44
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.65
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxan-2-ylmethylhydrazine;hydrochloride?
The IUPAC name of oxan-2-ylmethylhydrazine;hydrochloride (CID 121215429) is oxan-2-ylmethylhydrazine;hydrochloride.
What is the SMILES notation for oxan-2-ylmethylhydrazine;hydrochloride?
The canonical SMILES for oxan-2-ylmethylhydrazine;hydrochloride is Cl.NNCC1CCCCO1.
What is the InChIKey of oxan-2-ylmethylhydrazine;hydrochloride?
The InChIKey is PBZGQLYBZMXAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O.ClH/c7-8-5-6-3-1-2-4-9-6;/h6,8H,1-5,7H2;1H.
What are the key properties of oxan-2-ylmethylhydrazine;hydrochloride?
oxan-2-ylmethylhydrazine;hydrochloride has a molecular weight of 166.65 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-2-ylmethylhydrazine;hydrochloride is sourced from PubChem (CID 121215429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).