2-cyclohexylideneacetohydrazide;hydrochloride

C8H15ClN2O — CID 130670882

IUPAC2-cyclohexylideneacetohydrazide;hydrochloride
SMILESCl.NNC(=O)C=C1CCCCC1
InChIInChI=1S/C8H14N2O.ClH/c9-10-8(11)6-7-4-2-1-3-5-7;/h6H,1-5,9H2,(H,10,11);1H
InChIKeyHTEACHGXVBXJIB-UHFFFAOYSA-N
MW190.67 g/mol
LogP1.29
Rot. Bonds1

About 2-cyclohexylideneacetohydrazide;hydrochloride

2-cyclohexylideneacetohydrazide;hydrochloride (PubChem CID 130670882) has the molecular formula C8H15ClN2O and a molecular weight of 190.67 g/mol. Its IUPAC name is 2-cyclohexylideneacetohydrazide;hydrochloride.

Molecular Properties

Compound Name2-cyclohexylideneacetohydrazide;hydrochloride
PubChem CID130670882
Molecular FormulaC8H15ClN2O
Molecular Weight190.67 g/mol
Exact Mass190.09
IUPAC Name2-cyclohexylideneacetohydrazide;hydrochloride
SMILESCl.NNC(=O)C=C1CCCCC1
InChIInChI=1S/C8H14N2O.ClH/c9-10-8(11)6-7-4-2-1-3-5-7;/h6H,1-5,9H2,(H,10,11);1H
InChIKeyHTEACHGXVBXJIB-UHFFFAOYSA-N
XLogP1.29
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.67
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', '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 2-cyclohexylideneacetohydrazide;hydrochloride?
The IUPAC name of 2-cyclohexylideneacetohydrazide;hydrochloride (CID 130670882) is 2-cyclohexylideneacetohydrazide;hydrochloride.
What is the SMILES notation for 2-cyclohexylideneacetohydrazide;hydrochloride?
The canonical SMILES for 2-cyclohexylideneacetohydrazide;hydrochloride is Cl.NNC(=O)C=C1CCCCC1.
What is the InChIKey of 2-cyclohexylideneacetohydrazide;hydrochloride?
The InChIKey is HTEACHGXVBXJIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O.ClH/c9-10-8(11)6-7-4-2-1-3-5-7;/h6H,1-5,9H2,(H,10,11);1H.
What are the key properties of 2-cyclohexylideneacetohydrazide;hydrochloride?
2-cyclohexylideneacetohydrazide;hydrochloride has a molecular weight of 190.67 g/mol, XLogP of 1.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylideneacetohydrazide;hydrochloride is sourced from PubChem (CID 130670882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).