(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one

C10H18N2O — CID 6380817

IUPAC(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one
SMILESCN(C)/N=C1/CC(=O)CC(C)(C)C1
InChIInChI=1S/C10H18N2O/c1-10(2)6-8(11-12(3)4)5-9(13)7-10/h5-7H2,1-4H3/b11-8-
InChIKeyRNRAVVKLVZUPOT-FLIBITNWSA-N
MW182.27 g/mol
LogP1.68
Rot. Bonds1

About (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one

(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one (PubChem CID 6380817) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one.

Molecular Properties

Compound Name(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one
PubChem CID6380817
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one
SMILESCN(C)/N=C1/CC(=O)CC(C)(C)C1
InChIInChI=1S/C10H18N2O/c1-10(2)6-8(11-12(3)4)5-9(13)7-10/h5-7H2,1-4H3/b11-8-
InChIKeyRNRAVVKLVZUPOT-FLIBITNWSA-N
XLogP1.68
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_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 (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one?
The IUPAC name of (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one (CID 6380817) is (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one.
What is the SMILES notation for (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one?
The canonical SMILES for (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one is CN(C)/N=C1/CC(=O)CC(C)(C)C1.
What is the InChIKey of (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one?
The InChIKey is RNRAVVKLVZUPOT-FLIBITNWSA-N. The full InChI is InChI=1S/C10H18N2O/c1-10(2)6-8(11-12(3)4)5-9(13)7-10/h5-7H2,1-4H3/b11-8-.
What are the key properties of (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one?
(5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one has a molecular weight of 182.27 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(dimethylhydrazinylidene)-3,3-dimethylcyclohexan-1-one is sourced from PubChem (CID 6380817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).