(7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine

C12H13Cl2N3 — CID 63554990

IUPAC(7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine
SMILESCCc1nc2c(Cl)c(Cl)ccc2c(NN)c1C
InChIInChI=1S/C12H13Cl2N3/c1-3-9-6(2)11(17-15)7-4-5-8(13)10(14)12(7)16-9/h4-5H,3,15H2,1-2H3,(H,16,17)
InChIKeyVZGFPXVVMCKYHR-UHFFFAOYSA-N
MW270.16 g/mol
LogP3.70
Rot. Bonds2

About (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine

(7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine (PubChem CID 63554990) has the molecular formula C12H13Cl2N3 and a molecular weight of 270.16 g/mol. Its IUPAC name is (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine
PubChem CID63554990
Molecular FormulaC12H13Cl2N3
Molecular Weight270.16 g/mol
Exact Mass269.05
IUPAC Name(7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine
SMILESCCc1nc2c(Cl)c(Cl)ccc2c(NN)c1C
InChIInChI=1S/C12H13Cl2N3/c1-3-9-6(2)11(17-15)7-4-5-8(13)10(14)12(7)16-9/h4-5H,3,15H2,1-2H3,(H,16,17)
InChIKeyVZGFPXVVMCKYHR-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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Related Compounds

(2-ethyl-7,8-difluoro-3-methylquinolin-4-yl)hydrazine
CID 63554093
(5,6,8-trichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine
CID 63553722
(8-ethoxy-2-ethyl-3-methylquinolin-4-yl)hydrazine
CID 63553723
7,8-dichloro-3-ethyl-2-methylquinolin-4-amine
CID 62203586
(5,8-diethoxy-2-ethyl-3-methylquinolin-4-yl)hydrazine
CID 63555862
8-chloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63560531
N,2-diethyl-7,8-difluoro-3-methylquinolin-4-amine
CID 63553899
(2-ethyl-7-fluoro-3,6-dimethylquinolin-4-yl)hydrazine
CID 103996238
4,5-dichloro-2-ethyl-8-fluoro-3-methylquinoline
CID 63561489
(5,8-dichloro-3-ethyl-2-methylquinolin-4-yl)hydrazine
CID 63483882
6,8-dichloro-2-ethyl-3-methyl-N-propylquinolin-4-amine
CID 63562406
(7-chloro-2,3-diethylquinolin-4-yl)hydrazine
CID 156874809

Frequently Asked Questions

What is the IUPAC name of (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine?
The IUPAC name of (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine (CID 63554990) is (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine.
What is the SMILES notation for (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine?
The canonical SMILES for (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine is CCc1nc2c(Cl)c(Cl)ccc2c(NN)c1C.
What is the InChIKey of (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine?
The InChIKey is VZGFPXVVMCKYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2N3/c1-3-9-6(2)11(17-15)7-4-5-8(13)10(14)12(7)16-9/h4-5H,3,15H2,1-2H3,(H,16,17).
What are the key properties of (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine?
(7,8-dichloro-2-ethyl-3-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 (7,8-dichloro-2-ethyl-3-methylquinolin-4-yl)hydrazine is sourced from PubChem (CID 63554990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).