1-quinolin-3-ylbutylhydrazine

C13H17N3 — CID 105202157

IUPAC1-quinolin-3-ylbutylhydrazine
SMILESCCCC(NN)c1cnc2ccccc2c1
InChIInChI=1S/C13H17N3/c1-2-5-13(16-14)11-8-10-6-3-4-7-12(10)15-9-11/h3-4,6-9,13,16H,2,5,14H2,1H3
InChIKeyGOXFJYDKBDQHFT-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.54
Rot. Bonds4

About 1-quinolin-3-ylbutylhydrazine

1-quinolin-3-ylbutylhydrazine (PubChem CID 105202157) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-quinolin-3-ylbutylhydrazine.

Molecular Properties

Compound Name1-quinolin-3-ylbutylhydrazine
PubChem CID105202157
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name1-quinolin-3-ylbutylhydrazine
SMILESCCCC(NN)c1cnc2ccccc2c1
InChIInChI=1S/C13H17N3/c1-2-5-13(16-14)11-8-10-6-3-4-7-12(10)15-9-11/h3-4,6-9,13,16H,2,5,14H2,1H3
InChIKeyGOXFJYDKBDQHFT-UHFFFAOYSA-N
XLogP2.54
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 1-quinolin-3-ylbutylhydrazine?
The IUPAC name of 1-quinolin-3-ylbutylhydrazine (CID 105202157) is 1-quinolin-3-ylbutylhydrazine.
What is the SMILES notation for 1-quinolin-3-ylbutylhydrazine?
The canonical SMILES for 1-quinolin-3-ylbutylhydrazine is CCCC(NN)c1cnc2ccccc2c1.
What is the InChIKey of 1-quinolin-3-ylbutylhydrazine?
The InChIKey is GOXFJYDKBDQHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-2-5-13(16-14)11-8-10-6-3-4-7-12(10)15-9-11/h3-4,6-9,13,16H,2,5,14H2,1H3.
What are the key properties of 1-quinolin-3-ylbutylhydrazine?
1-quinolin-3-ylbutylhydrazine has a molecular weight of 215.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-3-ylbutylhydrazine is sourced from PubChem (CID 105202157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).