1-(3-hydrazinylidene-2H-indol-1-yl)ethanone

C10H11N3O — CID 85441037

IUPAC1-(3-hydrazinylidene-2H-indol-1-yl)ethanone
SMILESCC(=O)N1CC(=NN)c2ccccc21
InChIInChI=1S/C10H11N3O/c1-7(14)13-6-9(12-11)8-4-2-3-5-10(8)13/h2-5H,6,11H2,1H3
InChIKeyZMYOWIPEBYUKPF-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.72
Rot. Bonds

About 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone

1-(3-hydrazinylidene-2H-indol-1-yl)ethanone (PubChem CID 85441037) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone.

Molecular Properties

Compound Name1-(3-hydrazinylidene-2H-indol-1-yl)ethanone
PubChem CID85441037
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-(3-hydrazinylidene-2H-indol-1-yl)ethanone
SMILESCC(=O)N1CC(=NN)c2ccccc21
InChIInChI=1S/C10H11N3O/c1-7(14)13-6-9(12-11)8-4-2-3-5-10(8)13/h2-5H,6,11H2,1H3
InChIKeyZMYOWIPEBYUKPF-UHFFFAOYSA-N
XLogP0.72
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.72
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

1-(3-hydroxyimino-2H-indol-1-yl)ethanone
CID 71820179
1-acetyl-2H-indol-3-one
CID 538819
1-[(11Z)-12-amino-11-[amino(methyl)amino]-6H-benzo[c][1]benzazocin-5-yl]ethanone
CID 145302097
1-[(3E)-3-benzylidene-2H-indol-1-yl]ethanone
CID 24978376
1-(4-ethyl-2H-quinolin-1-yl)ethanone
CID 126493212
1-(9-butyl-6H-phenanthridin-5-yl)ethanone
CID 24766050
1-[(1-acetyl-2,3-dihydroquinolin-4-ylidene)amino]-3-phenylthiourea
CID 175010049
2-[[(11Z)-5-acetyl-12-amino-6H-benzo[c][1]benzazocin-11-yl]-aminoamino]acetamide;ethane
CID 142291738
methyl (2Z)-2-(1-acetyl-2H-indol-3-ylidene)-2-phenylacetate
CID 134961601
1-(5-propan-2-yl-3,4,5,13-tetrazatetracyclo[13.4.0.02,6.07,12]nonadeca-1(19),2(6),3,7,9,11,15,17-octaen-13-yl)ethanone
CID 155178454
6H-phenanthridine-5-carbonyl chloride
CID 86183224
1-[(2aR)-1-iodo-2a,3-dihydro-2H-cyclobuta[c]quinolin-4-yl]ethanone
CID 139180110

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone?
The IUPAC name of 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone (CID 85441037) is 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone.
What is the SMILES notation for 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone?
The canonical SMILES for 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone is CC(=O)N1CC(=NN)c2ccccc21.
What is the InChIKey of 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone?
The InChIKey is ZMYOWIPEBYUKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7(14)13-6-9(12-11)8-4-2-3-5-10(8)13/h2-5H,6,11H2,1H3.
What are the key properties of 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone?
1-(3-hydrazinylidene-2H-indol-1-yl)ethanone has a molecular weight of 189.22 g/mol, XLogP of 0.72, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydrazinylidene-2H-indol-1-yl)ethanone is sourced from PubChem (CID 85441037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).