4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one

C10H14N2O — CID 156776019

IUPAC4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one
SMILESNN=C1CC(=O)CC2CCCC=C12
InChIInChI=1S/C10H14N2O/c11-12-10-6-8(13)5-7-3-1-2-4-9(7)10/h4,7H,1-3,5-6,11H2
InChIKeyCNPPEEKCLRPEDQ-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.39
Rot. Bonds

About 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one

4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one (PubChem CID 156776019) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one.

Molecular Properties

Compound Name4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one
PubChem CID156776019
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one
SMILESNN=C1CC(=O)CC2CCCC=C12
InChIInChI=1S/C10H14N2O/c11-12-10-6-8(13)5-7-3-1-2-4-9(7)10/h4,7H,1-3,5-6,11H2
InChIKeyCNPPEEKCLRPEDQ-UHFFFAOYSA-N
XLogP1.39
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

5-Imino-1,3,4,4a,6,8a-hexahydronaphthalen-2-one
CID 57115373
2-Diazo-3,5,6,7,8,8a-hexahydronaphthalen-1-one
CID 59968537
6-Imino-2,3,4,4a,5,8a-hexahydronaphthalen-1-one
CID 90712963
8-Imino-1,3,5,8a-tetrahydronaphthalen-2-one
CID 91425909
(2E)-2-diazo-4a,5,6,7,8,8a-hexahydronaphthalen-1-one
CID 145860242
(4aS,8R,8aR)-2-diazo-5-methyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-one
CID 10657230
6-Diazonioimino-7-(iminohydrazinylidene)-1,8-dioxo-2,8a-dihydronaphthalene
CID 57192611

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one?
The IUPAC name of 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one (CID 156776019) is 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one.
What is the SMILES notation for 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one?
The canonical SMILES for 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one is NN=C1CC(=O)CC2CCCC=C12.
What is the InChIKey of 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one?
The InChIKey is CNPPEEKCLRPEDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c11-12-10-6-8(13)5-7-3-1-2-4-9(7)10/h4,7H,1-3,5-6,11H2.
What are the key properties of 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one?
4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one has a molecular weight of 178.23 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinylidene-6,7,8,8a-tetrahydro-1H-naphthalen-2-one is sourced from PubChem (CID 156776019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).