[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine

C16H21N3 — CID 105310111

IUPAC[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine
SMILESCc1cc(C(CC2CCC2)NN)c2ccccc2n1
InChIInChI=1S/C16H21N3/c1-11-9-14(13-7-2-3-8-15(13)18-11)16(19-17)10-12-5-4-6-12/h2-3,7-9,12,16,19H,4-6,10,17H2,1H3
InChIKeyOJZZUEHERKOFIS-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.24
Rot. Bonds4

About [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine

[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine (PubChem CID 105310111) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine
PubChem CID105310111
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine
SMILESCc1cc(C(CC2CCC2)NN)c2ccccc2n1
InChIInChI=1S/C16H21N3/c1-11-9-14(13-7-2-3-8-15(13)18-11)16(19-17)10-12-5-4-6-12/h2-3,7-9,12,16,19H,4-6,10,17H2,1H3
InChIKeyOJZZUEHERKOFIS-UHFFFAOYSA-N
XLogP3.24
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.24
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 [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine (CID 105310111) is [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine is Cc1cc(C(CC2CCC2)NN)c2ccccc2n1.
What is the InChIKey of [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine?
The InChIKey is OJZZUEHERKOFIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-11-9-14(13-7-2-3-8-15(13)18-11)16(19-17)10-12-5-4-6-12/h2-3,7-9,12,16,19H,4-6,10,17H2,1H3.
What are the key properties of [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine?
[2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine has a molecular weight of 255.37 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclobutyl-1-(2-methylquinolin-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105310111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).