2-cyclohexylideneacetohydrazide;yttrium

C8H13N2OY- — CID 58399083

IUPAC2-cyclohexylideneacetohydrazide;yttrium
SMILESNNC(=O)[C-]=C1CCCCC1.[Y]
InChIInChI=1S/C8H13N2O.Y/c9-10-8(11)6-7-4-2-1-3-5-7;/h1-5,9H2,(H,10,11);/q-1;
InChIKeyIIOHSFZBRGCEDA-UHFFFAOYSA-N
MW242.11 g/mol
LogP0.67
Rot. Bonds1

About 2-cyclohexylideneacetohydrazide;yttrium

2-cyclohexylideneacetohydrazide;yttrium (PubChem CID 58399083) has the molecular formula C8H13N2OY- and a molecular weight of 242.11 g/mol. Its IUPAC name is 2-cyclohexylideneacetohydrazide;yttrium.

Molecular Properties

Compound Name2-cyclohexylideneacetohydrazide;yttrium
PubChem CID58399083
Molecular FormulaC8H13N2OY-
Molecular Weight242.11 g/mol
Exact Mass242.01
IUPAC Name2-cyclohexylideneacetohydrazide;yttrium
SMILESNNC(=O)[C-]=C1CCCCC1.[Y]
InChIInChI=1S/C8H13N2O.Y/c9-10-8(11)6-7-4-2-1-3-5-7;/h1-5,9H2,(H,10,11);/q-1;
InChIKeyIIOHSFZBRGCEDA-UHFFFAOYSA-N
XLogP0.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.11
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', '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;yttrium?
The IUPAC name of 2-cyclohexylideneacetohydrazide;yttrium (CID 58399083) is 2-cyclohexylideneacetohydrazide;yttrium.
What is the SMILES notation for 2-cyclohexylideneacetohydrazide;yttrium?
The canonical SMILES for 2-cyclohexylideneacetohydrazide;yttrium is NNC(=O)[C-]=C1CCCCC1.[Y].
What is the InChIKey of 2-cyclohexylideneacetohydrazide;yttrium?
The InChIKey is IIOHSFZBRGCEDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N2O.Y/c9-10-8(11)6-7-4-2-1-3-5-7;/h1-5,9H2,(H,10,11);/q-1;.
What are the key properties of 2-cyclohexylideneacetohydrazide;yttrium?
2-cyclohexylideneacetohydrazide;yttrium has a molecular weight of 242.11 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylideneacetohydrazide;yttrium is sourced from PubChem (CID 58399083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).