(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine

C12H13BrFN3 — CID 63233439

IUPAC(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine
SMILESCCCc1cc2c(Br)ccc(F)c2nc1NN
InChIInChI=1S/C12H13BrFN3/c1-2-3-7-6-8-9(13)4-5-10(14)11(8)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyMIKDIHQKXCAIHQ-UHFFFAOYSA-N
MW298.16 g/mol
LogP3.37
Rot. Bonds3

About (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine

(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine (PubChem CID 63233439) has the molecular formula C12H13BrFN3 and a molecular weight of 298.16 g/mol. Its IUPAC name is (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine.

Molecular Properties

Compound Name(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine
PubChem CID63233439
Molecular FormulaC12H13BrFN3
Molecular Weight298.16 g/mol
Exact Mass297.03
IUPAC Name(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine
SMILESCCCc1cc2c(Br)ccc(F)c2nc1NN
InChIInChI=1S/C12H13BrFN3/c1-2-3-7-6-8-9(13)4-5-10(14)11(8)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyMIKDIHQKXCAIHQ-UHFFFAOYSA-N
XLogP3.37
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.16
LogP ≤ 53.37
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-bromo-8-fluoro-N,3-dipropylquinolin-2-amine
CID 63524550
5-bromo-2-chloro-8-fluoro-3-propylquinoline
CID 63530205
(3-ethyl-8-fluoro-5-methylquinolin-2-yl)hydrazine
CID 63232243
(5,7-difluoro-3-propylquinolin-2-yl)hydrazine
CID 63232528
(5-bromo-3-ethyl-8-methoxyquinolin-2-yl)hydrazine
CID 63233442
(3-ethyl-5-fluoro-8-methylquinolin-2-yl)hydrazine
CID 63232655
N-ethyl-5,6,8-trifluoro-3-propylquinolin-2-amine
CID 55223170
N-ethyl-5-fluoro-8-methyl-3-propylquinolin-2-amine
CID 63523830
6-bromo-8-fluoro-N-methyl-3-propylquinolin-2-amine
CID 63526300
(6-chloro-3-ethyl-8-fluoroquinolin-2-yl)hydrazine
CID 63232613
(8-chloro-5-methoxy-3-propylquinolin-2-yl)hydrazine
CID 63233166
(3-propyl-1,8-phenanthrolin-2-yl)hydrazine
CID 63232788

Frequently Asked Questions

What is the IUPAC name of (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine?
The IUPAC name of (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine (CID 63233439) is (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine.
What is the SMILES notation for (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine?
The canonical SMILES for (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine is CCCc1cc2c(Br)ccc(F)c2nc1NN.
What is the InChIKey of (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine?
The InChIKey is MIKDIHQKXCAIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrFN3/c1-2-3-7-6-8-9(13)4-5-10(14)11(8)16-12(7)17-15/h4-6H,2-3,15H2,1H3,(H,16,17).
What are the key properties of (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine?
(5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine has a molecular weight of 298.16 g/mol, XLogP of 3.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-8-fluoro-3-propylquinolin-2-yl)hydrazine is sourced from PubChem (CID 63233439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).