3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one

C16H14N4O — CID 172939962

IUPAC3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one
SMILESN/N=C1/c2ccccc2NC1C1C(=O)Nc2ccccc21
InChIInChI=1S/C16H14N4O/c17-20-14-10-6-2-4-8-12(10)18-15(14)13-9-5-1-3-7-11(9)19-16(13)21/h1-8,13,15,18H,17H2,(H,19,21)/b20-14-
InChIKeyBVCHBCHZGUARSB-ZHZULCJRSA-N
MW278.31 g/mol
LogP1.88
Rot. Bonds1

About 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one

3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one (PubChem CID 172939962) has the molecular formula C16H14N4O and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one
PubChem CID172939962
Molecular FormulaC16H14N4O
Molecular Weight278.31 g/mol
Exact Mass278.12
IUPAC Name3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one
SMILESN/N=C1/c2ccccc2NC1C1C(=O)Nc2ccccc21
InChIInChI=1S/C16H14N4O/c17-20-14-10-6-2-4-8-12(10)18-15(14)13-9-5-1-3-7-11(9)19-16(13)21/h1-8,13,15,18H,17H2,(H,19,21)/b20-14-
InChIKeyBVCHBCHZGUARSB-ZHZULCJRSA-N
XLogP1.88
TPSA79.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

(6aR,7S,12aR)-7-phenyl-6a,7,12,12a-tetrahydro-5H-quinolino[3,2-c]quinolin-6-one
CID 134962981
(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-ol
CID 172956620
3-[5-[2-(2-oxo-1,3-dihydroindol-3-yl)-2H-thiophen-5-ylidene]-2H-thiophen-2-yl]-1,3-dihydroindol-2-one
CID 5083376
3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one
CID 106986757
[(3R)-2-oxo-1,3-dihydroindol-3-yl]azanium
CID 6921460
4-chloro-6,10b-dihydro-4aH-benzo[c][2,7]naphthyridin-5-one
CID 10537564
(2-oxo-1,3-dihydroindol-3-yl) hydrogen sulfate
CID 157010389
5-chloro-3-[(3Z)-5-hydroxy-3-hydroxyimino-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one
CID 135998444
(3R)-1-methyl-3-[(3R)-2-oxo-1,3-dihydroindol-3-yl]-3H-indol-2-one
CID 102025482
3-[(E)-3-cyclopropylprop-2-enoyl]-4-phenyl-3,4-dihydro-1H-quinolin-2-one
CID 167131973
oxo-[(2-oxo-1,3-dihydroindol-3-yl)methyl]sulfanium
CID 175320984
3-(3-aminoprop-2-enyl)-1,3-dihydroindol-2-one
CID 70440034

Frequently Asked Questions

What is the IUPAC name of 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one?
The IUPAC name of 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one (CID 172939962) is 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one?
The canonical SMILES for 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one is N/N=C1/c2ccccc2NC1C1C(=O)Nc2ccccc21.
What is the InChIKey of 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one?
The InChIKey is BVCHBCHZGUARSB-ZHZULCJRSA-N. The full InChI is InChI=1S/C16H14N4O/c17-20-14-10-6-2-4-8-12(10)18-15(14)13-9-5-1-3-7-11(9)19-16(13)21/h1-8,13,15,18H,17H2,(H,19,21)/b20-14-.
What are the key properties of 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one?
3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one has a molecular weight of 278.31 g/mol, XLogP of 1.88, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3Z)-3-hydrazinylidene-1,2-dihydroindol-2-yl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 172939962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).