(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine

C12H13BrClN3 — CID 63483522

IUPAC(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine
SMILESCCCc1cc(NN)c2cc(Br)cc(Cl)c2n1
InChIInChI=1S/C12H13BrClN3/c1-2-3-8-6-11(17-15)9-4-7(13)5-10(14)12(9)16-8/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyRSAPYOQKXGFOJE-UHFFFAOYSA-N
MW314.61 g/mol
LogP3.89
Rot. Bonds3

About (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine

(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine (PubChem CID 63483522) has the molecular formula C12H13BrClN3 and a molecular weight of 314.61 g/mol. Its IUPAC name is (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine
PubChem CID63483522
Molecular FormulaC12H13BrClN3
Molecular Weight314.61 g/mol
Exact Mass313.00
IUPAC Name(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine
SMILESCCCc1cc(NN)c2cc(Br)cc(Cl)c2n1
InChIInChI=1S/C12H13BrClN3/c1-2-3-8-6-11(17-15)9-4-7(13)5-10(14)12(9)16-8/h4-6H,2-3,15H2,1H3,(H,16,17)
InChIKeyRSAPYOQKXGFOJE-UHFFFAOYSA-N
XLogP3.89
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.61
LogP ≤ 53.89
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

6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine
CID 63479402
(8-chloro-6-iodo-2-propylquinolin-4-yl)hydrazine
CID 107607953
6-bromo-8-chloro-2-ethyl-N-methylquinolin-4-amine
CID 63479737
8-chloro-N-ethyl-6-methyl-2-propylquinolin-4-amine
CID 63479378
8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
CID 63479380
6-bromo-8-ethyl-N-methyl-2-propylquinolin-4-amine
CID 81288812
[6,8-dibromo-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 62318850
(8-bromo-5-methyl-2-propylquinolin-4-yl)hydrazine
CID 82758079
[6-bromo-7,8-dichloro-2-(methoxymethyl)quinolin-4-yl]hydrazine
CID 107794014
6-bromo-8-chloro-N-ethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63479069
(2-propyl-7,8,9,10-tetrahydrobenzo[h]quinolin-4-yl)hydrazine
CID 63484240
(5,8-difluoro-2-propylquinolin-4-yl)hydrazine
CID 62250593

Frequently Asked Questions

What is the IUPAC name of (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine?
The IUPAC name of (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine (CID 63483522) is (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine.
What is the SMILES notation for (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine?
The canonical SMILES for (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine is CCCc1cc(NN)c2cc(Br)cc(Cl)c2n1.
What is the InChIKey of (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine?
The InChIKey is RSAPYOQKXGFOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrClN3/c1-2-3-8-6-11(17-15)9-4-7(13)5-10(14)12(9)16-8/h4-6H,2-3,15H2,1H3,(H,16,17).
What are the key properties of (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine?
(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine has a molecular weight of 314.61 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine is sourced from PubChem (CID 63483522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).