3-(methylhydrazinylidene)inden-1-one

C10H10N2O — CID 3485546

IUPAC3-(methylhydrazinylidene)inden-1-one
SMILESCNN=C1CC(=O)c2ccccc21
InChIInChI=1S/C10H10N2O/c1-11-12-9-6-10(13)8-5-3-2-4-7(8)9/h2-5,11H,6H2,1H3
InChIKeyNRDYZLSIZYUHNH-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.20
Rot. Bonds1

About 3-(methylhydrazinylidene)inden-1-one

3-(methylhydrazinylidene)inden-1-one (PubChem CID 3485546) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-(methylhydrazinylidene)inden-1-one.

Molecular Properties

Compound Name3-(methylhydrazinylidene)inden-1-one
PubChem CID3485546
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-(methylhydrazinylidene)inden-1-one
SMILESCNN=C1CC(=O)c2ccccc21
InChIInChI=1S/C10H10N2O/c1-11-12-9-6-10(13)8-5-3-2-4-7(8)9/h2-5,11H,6H2,1H3
InChIKeyNRDYZLSIZYUHNH-UHFFFAOYSA-N
XLogP1.20
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.20
H-Bond Donors ≤ 51
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 3-(methylhydrazinylidene)inden-1-one?
The IUPAC name of 3-(methylhydrazinylidene)inden-1-one (CID 3485546) is 3-(methylhydrazinylidene)inden-1-one.
What is the SMILES notation for 3-(methylhydrazinylidene)inden-1-one?
The canonical SMILES for 3-(methylhydrazinylidene)inden-1-one is CNN=C1CC(=O)c2ccccc21.
What is the InChIKey of 3-(methylhydrazinylidene)inden-1-one?
The InChIKey is NRDYZLSIZYUHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-11-12-9-6-10(13)8-5-3-2-4-7(8)9/h2-5,11H,6H2,1H3.
What are the key properties of 3-(methylhydrazinylidene)inden-1-one?
3-(methylhydrazinylidene)inden-1-one has a molecular weight of 174.20 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylhydrazinylidene)inden-1-one is sourced from PubChem (CID 3485546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).