[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine

C13H16N4O2S — CID 62245796

IUPAC[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine
SMILESNNc1nc2ccccc2cc1CN1CCCS1(=O)=O
InChIInChI=1S/C13H16N4O2S/c14-16-13-11(9-17-6-3-7-20(17,18)19)8-10-4-1-2-5-12(10)15-13/h1-2,4-5,8H,3,6-7,9,14H2,(H,15,16)
InChIKeyGZKQMRKGGDBLMA-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.06
Rot. Bonds3

About [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine

[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine (PubChem CID 62245796) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine.

Molecular Properties

Compound Name[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine
PubChem CID62245796
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC Name[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine
SMILESNNc1nc2ccccc2cc1CN1CCCS1(=O)=O
InChIInChI=1S/C13H16N4O2S/c14-16-13-11(9-17-6-3-7-20(17,18)19)8-10-4-1-2-5-12(10)15-13/h1-2,4-5,8H,3,6-7,9,14H2,(H,15,16)
InChIKeyGZKQMRKGGDBLMA-UHFFFAOYSA-N
XLogP1.06
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine?
The IUPAC name of [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine (CID 62245796) is [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine.
What is the SMILES notation for [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine?
The canonical SMILES for [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine is NNc1nc2ccccc2cc1CN1CCCS1(=O)=O.
What is the InChIKey of [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine?
The InChIKey is GZKQMRKGGDBLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c14-16-13-11(9-17-6-3-7-20(17,18)19)8-10-4-1-2-5-12(10)15-13/h1-2,4-5,8H,3,6-7,9,14H2,(H,15,16).
What are the key properties of [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine?
[3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine has a molecular weight of 292.36 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]quinolin-2-yl]hydrazine is sourced from PubChem (CID 62245796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).