1-quinolin-2-ylbut-3-enylhydrazine

C13H15N3 — CID 105218718

IUPAC1-quinolin-2-ylbut-3-enylhydrazine
SMILESC=CCC(NN)c1ccc2ccccc2n1
InChIInChI=1S/C13H15N3/c1-2-5-13(16-14)12-9-8-10-6-3-4-7-11(10)15-12/h2-4,6-9,13,16H,1,5,14H2
InChIKeyJEHSSGKQYUMCDC-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.32
Rot. Bonds4

About 1-quinolin-2-ylbut-3-enylhydrazine

1-quinolin-2-ylbut-3-enylhydrazine (PubChem CID 105218718) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-quinolin-2-ylbut-3-enylhydrazine.

Molecular Properties

Compound Name1-quinolin-2-ylbut-3-enylhydrazine
PubChem CID105218718
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name1-quinolin-2-ylbut-3-enylhydrazine
SMILESC=CCC(NN)c1ccc2ccccc2n1
InChIInChI=1S/C13H15N3/c1-2-5-13(16-14)12-9-8-10-6-3-4-7-11(10)15-12/h2-4,6-9,13,16H,1,5,14H2
InChIKeyJEHSSGKQYUMCDC-UHFFFAOYSA-N
XLogP2.32
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-quinolin-2-ylpent-3-ynylhydrazine
CID 105218650
[2-(2-chlorophenyl)-1-quinolin-2-ylethyl]hydrazine
CID 105218699
[2-(4-methylphenyl)-1-quinolin-2-ylethyl]hydrazine
CID 105218734
(3-methyl-1-quinolin-2-ylhexyl)hydrazine
CID 105218682
N-methyl-1-quinolin-2-yloct-7-en-1-amine
CID 107009092
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine
CID 105218619
1-phenylbut-3-enylhydrazine
CID 105199312
1-quinolin-2-ylprop-2-en-1-ol
CID 65416491
(1S)-2-amino-1-quinolin-2-ylethanol
CID 96808696
2-quinolin-2-ylhex-5-enamide
CID 139684131
N-prop-2-enyl-2-quinolin-2-ylpropanethioamide
CID 88842883
1-(2-chlorofuran-3-yl)but-3-enylhydrazine
CID 106694221

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-2-ylbut-3-enylhydrazine?
The IUPAC name of 1-quinolin-2-ylbut-3-enylhydrazine (CID 105218718) is 1-quinolin-2-ylbut-3-enylhydrazine.
What is the SMILES notation for 1-quinolin-2-ylbut-3-enylhydrazine?
The canonical SMILES for 1-quinolin-2-ylbut-3-enylhydrazine is C=CCC(NN)c1ccc2ccccc2n1.
What is the InChIKey of 1-quinolin-2-ylbut-3-enylhydrazine?
The InChIKey is JEHSSGKQYUMCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-2-5-13(16-14)12-9-8-10-6-3-4-7-11(10)15-12/h2-4,6-9,13,16H,1,5,14H2.
What are the key properties of 1-quinolin-2-ylbut-3-enylhydrazine?
1-quinolin-2-ylbut-3-enylhydrazine has a molecular weight of 213.28 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-2-ylbut-3-enylhydrazine is sourced from PubChem (CID 105218718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).