(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine

C12H13Cl2N3 — CID 63483882

IUPAC(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine
SMILESCCc1c(C)nc2c(Cl)ccc(Cl)c2c1NN
InChIInChI=1S/C12H13Cl2N3/c1-3-7-6(2)16-12-9(14)5-4-8(13)10(12)11(7)17-15/h4-5H,3,15H2,1-2H3,(H,16,17)
InChIKeyNGRMFFQCGZKDNF-UHFFFAOYSA-N
MW270.16 g/mol
LogP3.70
Rot. Bonds2

About (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine

(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine (PubChem CID 63483882) has the molecular formula C12H13Cl2N3 and a molecular weight of 270.16 g/mol. Its IUPAC name is (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine
PubChem CID63483882
Molecular FormulaC12H13Cl2N3
Molecular Weight270.16 g/mol
Exact Mass269.05
IUPAC Name(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine
SMILESCCc1c(C)nc2c(Cl)ccc(Cl)c2c1NN
InChIInChI=1S/C12H13Cl2N3/c1-3-7-6(2)16-12-9(14)5-4-8(13)10(12)11(7)17-15/h4-5H,3,15H2,1-2H3,(H,16,17)
InChIKeyNGRMFFQCGZKDNF-UHFFFAOYSA-N
XLogP3.70
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 53.70
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 (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine?
The IUPAC name of (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine (CID 63483882) is (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine.
What is the SMILES notation for (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine?
The canonical SMILES for (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine is CCc1c(C)nc2c(Cl)ccc(Cl)c2c1NN.
What is the InChIKey of (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine?
The InChIKey is NGRMFFQCGZKDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2N3/c1-3-7-6(2)16-12-9(14)5-4-8(13)10(12)11(7)17-15/h4-5H,3,15H2,1-2H3,(H,16,17).
What are the key properties of (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine?
(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine has a molecular weight of 270.16 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine is sourced from PubChem (CID 63483882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).