(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one

C11H12N2O — CID 126737662

IUPAC(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one
SMILESCC1C=C2C=CC=CC2/C(=N/N)C1=O
InChIInChI=1S/C11H12N2O/c1-7-6-8-4-2-3-5-9(8)10(13-12)11(7)14/h2-7,9H,12H2,1H3/b13-10-
InChIKeyMNAYLUXIOGJNMR-RAXLEYEMSA-N
MW188.23 g/mol
LogP1.19
Rot. Bonds

About (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one

(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one (PubChem CID 126737662) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one.

Molecular Properties

Compound Name(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one
PubChem CID126737662
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one
SMILESCC1C=C2C=CC=CC2/C(=N/N)C1=O
InChIInChI=1S/C11H12N2O/c1-7-6-8-4-2-3-5-9(8)10(13-12)11(7)14/h2-7,9H,12H2,1H3/b13-10-
InChIKeyMNAYLUXIOGJNMR-RAXLEYEMSA-N
XLogP1.19
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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 (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one?
The IUPAC name of (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one (CID 126737662) is (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one.
What is the SMILES notation for (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one?
The canonical SMILES for (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one is CC1C=C2C=CC=CC2/C(=N/N)C1=O.
What is the InChIKey of (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one?
The InChIKey is MNAYLUXIOGJNMR-RAXLEYEMSA-N. The full InChI is InChI=1S/C11H12N2O/c1-7-6-8-4-2-3-5-9(8)10(13-12)11(7)14/h2-7,9H,12H2,1H3/b13-10-.
What are the key properties of (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one?
(1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one has a molecular weight of 188.23 g/mol, XLogP of 1.19, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1-hydrazinylidene-3-methyl-3,8a-dihydronaphthalen-2-one is sourced from PubChem (CID 126737662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).