3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide

C21H20N4O2 — CID 31830439

IUPAC3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
SMILESO=C(CCn1ccc2ccccc21)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C21H20N4O2/c26-20(10-12-25-11-9-15-5-1-4-8-19(15)25)23-24-21(27)13-16-14-22-18-7-3-2-6-17(16)18/h1-9,11,14,22H,10,12-13H2,(H,23,26)(H,24,27)
InChIKeyGWLCHOAZWLRWJF-UHFFFAOYSA-N
MW360.42 g/mol
LogP2.90
Rot. Bonds5

About 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide

3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide (PubChem CID 31830439) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide.

Molecular Properties

Compound Name3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
PubChem CID31830439
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
SMILESO=C(CCn1ccc2ccccc21)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C21H20N4O2/c26-20(10-12-25-11-9-15-5-1-4-8-19(15)25)23-24-21(27)13-16-14-22-18-7-3-2-6-17(16)18/h1-9,11,14,22H,10,12-13H2,(H,23,26)(H,24,27)
InChIKeyGWLCHOAZWLRWJF-UHFFFAOYSA-N
XLogP2.90
TPSA78.92 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 52.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(1H-indol-3-ylmethyl)indole
CID 15949032
4-(1H-indol-3-yl)-N'-[2-(1H-indol-3-yl)acetyl]butanehydrazide
CID 29437828
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-3-indol-1-ylpropanamide
CID 71709006
N'-[2-(1H-indol-3-yl)acetyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanehydrazide
CID 29220127
N'-[2-(1H-indol-3-yl)acetyl]-3-methylsulfanylpropanehydrazide
CID 18164303
N'-[2-(1H-indol-3-yl)acetyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanehydrazide
CID 24665687
2-(1H-indol-3-yl)-N'-[2-(9-oxoacridin-10-yl)acetyl]acetohydrazide
CID 31860262
N'-[2-(1H-indol-3-yl)acetyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanehydrazide
CID 39430911
N-[3-[2-[2-(1H-indol-3-yl)acetyl]hydrazinyl]-3-oxopropyl]benzamide
CID 26933063
N'-[2-(1H-indol-3-yl)acetyl]naphthalene-2-carbohydrazide
CID 31828968
N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
CID 29437842
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633

Frequently Asked Questions

What is the IUPAC name of 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide?
The IUPAC name of 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide (CID 31830439) is 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide.
What is the SMILES notation for 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide?
The canonical SMILES for 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide is O=C(CCn1ccc2ccccc21)NNC(=O)Cc1c[nH]c2ccccc12.
What is the InChIKey of 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide?
The InChIKey is GWLCHOAZWLRWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c26-20(10-12-25-11-9-15-5-1-4-8-19(15)25)23-24-21(27)13-16-14-22-18-7-3-2-6-17(16)18/h1-9,11,14,22H,10,12-13H2,(H,23,26)(H,24,27).
What are the key properties of 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide?
3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide has a molecular weight of 360.42 g/mol, XLogP of 2.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-indol-1-yl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide is sourced from PubChem (CID 31830439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).