(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine

C15H18FN3 — CID 113390617

IUPAC(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine
SMILESCc1cc2c(NN)cc(C3CCCC3)nc2cc1F
InChIInChI=1S/C15H18FN3/c1-9-6-11-14(7-12(9)16)18-13(8-15(11)19-17)10-4-2-3-5-10/h6-8,10H,2-5,17H2,1H3,(H,18,19)
InChIKeyJASSHROQMXMAMC-UHFFFAOYSA-N
MW259.33 g/mol
LogP3.63
Rot. Bonds2

About (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine

(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine (PubChem CID 113390617) has the molecular formula C15H18FN3 and a molecular weight of 259.33 g/mol. Its IUPAC name is (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine
PubChem CID113390617
Molecular FormulaC15H18FN3
Molecular Weight259.33 g/mol
Exact Mass259.15
IUPAC Name(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine
SMILESCc1cc2c(NN)cc(C3CCCC3)nc2cc1F
InChIInChI=1S/C15H18FN3/c1-9-6-11-14(7-12(9)16)18-13(8-15(11)19-17)10-4-2-3-5-10/h6-8,10H,2-5,17H2,1H3,(H,18,19)
InChIKeyJASSHROQMXMAMC-UHFFFAOYSA-N
XLogP3.63
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 53.63
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-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine?
The IUPAC name of (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine (CID 113390617) is (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine.
What is the SMILES notation for (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine?
The canonical SMILES for (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine is Cc1cc2c(NN)cc(C3CCCC3)nc2cc1F.
What is the InChIKey of (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine?
The InChIKey is JASSHROQMXMAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3/c1-9-6-11-14(7-12(9)16)18-13(8-15(11)19-17)10-4-2-3-5-10/h6-8,10H,2-5,17H2,1H3,(H,18,19).
What are the key properties of (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine?
(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine has a molecular weight of 259.33 g/mol, XLogP of 3.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine is sourced from PubChem (CID 113390617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).