(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine

C12H13ClFN3 — CID 107370736

IUPAC(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
SMILESCCCc1cc2c(Cl)cc(F)cc2nc1NN
InChIInChI=1S/C12H13ClFN3/c1-2-3-7-4-9-10(13)5-8(14)6-11(9)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyWJBNQUDCLFKLQS-UHFFFAOYSA-N
MW253.71 g/mol
LogP3.27
Rot. Bonds3

About (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine

(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine (PubChem CID 107370736) has the molecular formula C12H13ClFN3 and a molecular weight of 253.71 g/mol. Its IUPAC name is (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine.

Molecular Properties

Compound Name(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
PubChem CID107370736
Molecular FormulaC12H13ClFN3
Molecular Weight253.71 g/mol
Exact Mass253.08
IUPAC Name(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
SMILESCCCc1cc2c(Cl)cc(F)cc2nc1NN
InChIInChI=1S/C12H13ClFN3/c1-2-3-7-4-9-10(13)5-8(14)6-11(9)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyWJBNQUDCLFKLQS-UHFFFAOYSA-N
XLogP3.27
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.71
LogP ≤ 53.27
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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Related Compounds

(5,7-difluoro-3-propylquinolin-2-yl)hydrazine
CID 63232528
(6-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
CID 103997017
5,7-dichloro-N-ethyl-6-fluoro-3-propylquinolin-2-amine
CID 107579458
(3-ethyl-7-fluoro-5-methylquinolin-2-yl)hydrazine
CID 79046825
3-tert-butyl-5-chloro-N-ethyl-7-fluoroquinolin-2-amine
CID 107370729
2-chloro-5,7-difluoro-3-propylquinoline
CID 63231572
(8-chloro-5-methoxy-3-propylquinolin-2-yl)hydrazine
CID 63233166
(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine
CID 63233439
(6-ethoxy-7-fluoro-3-propylquinolin-2-yl)hydrazine
CID 113399828
N-(2,6-dichloro-4-fluorophenyl)-6-hydrazinyl-2-propylpyrimidin-4-amine
CID 83073478
(7-chloro-2-propylquinazolin-4-yl)hydrazine
CID 106583898
(3-ethyl-6-fluoro-8-methylquinolin-2-yl)hydrazine
CID 63232452

Frequently Asked Questions

What is the IUPAC name of (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine?
The IUPAC name of (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine (CID 107370736) is (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine.
What is the SMILES notation for (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine?
The canonical SMILES for (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine is CCCc1cc2c(Cl)cc(F)cc2nc1NN.
What is the InChIKey of (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine?
The InChIKey is WJBNQUDCLFKLQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClFN3/c1-2-3-7-4-9-10(13)5-8(14)6-11(9)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17).
What are the key properties of (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine?
(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine has a molecular weight of 253.71 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine is sourced from PubChem (CID 107370736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).