1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride

C9H19ClN2 — CID 19049062

IUPAC1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride
SMILESCNN/C1=C/CCCCCC1.Cl
InChIInChI=1S/C9H18N2.ClH/c1-10-11-9-7-5-3-2-4-6-8-9;/h7,10-11H,2-6,8H2,1H3;1H/b9-7+;
InChIKeyOOVMRCFEEJILMO-BXTVWIJMSA-N
MW190.72 g/mol
LogP2.37
Rot. Bonds2

About 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride

1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride (PubChem CID 19049062) has the molecular formula C9H19ClN2 and a molecular weight of 190.72 g/mol. Its IUPAC name is 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride.

Molecular Properties

Compound Name1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride
PubChem CID19049062
Molecular FormulaC9H19ClN2
Molecular Weight190.72 g/mol
Exact Mass190.12
IUPAC Name1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride
SMILESCNN/C1=C/CCCCCC1.Cl
InChIInChI=1S/C9H18N2.ClH/c1-10-11-9-7-5-3-2-4-6-8-9;/h7,10-11H,2-6,8H2,1H3;1H/b9-7+;
InChIKeyOOVMRCFEEJILMO-BXTVWIJMSA-N
XLogP2.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.72
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride?
The IUPAC name of 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride (CID 19049062) is 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride.
What is the SMILES notation for 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride?
The canonical SMILES for 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride is CNN/C1=C/CCCCCC1.Cl.
What is the InChIKey of 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride?
The InChIKey is OOVMRCFEEJILMO-BXTVWIJMSA-N. The full InChI is InChI=1S/C9H18N2.ClH/c1-10-11-9-7-5-3-2-4-6-8-9;/h7,10-11H,2-6,8H2,1H3;1H/b9-7+;.
What are the key properties of 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride?
1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride has a molecular weight of 190.72 g/mol, XLogP of 2.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1E)-cycloocten-1-yl]-2-methylhydrazine;hydrochloride is sourced from PubChem (CID 19049062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).