(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine

C13H15Cl2N3 — CID 63386184

IUPAC(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine
SMILESCC(C)(C)c1cc2c(Cl)cc(Cl)cc2nc1NN
InChIInChI=1S/C13H15Cl2N3/c1-13(2,3)9-6-8-10(15)4-7(14)5-11(8)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyZNISYSFZDZTVJV-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.12
Rot. Bonds1

About (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine

(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine (PubChem CID 63386184) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine.

Molecular Properties

Compound Name(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine
PubChem CID63386184
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine
SMILESCC(C)(C)c1cc2c(Cl)cc(Cl)cc2nc1NN
InChIInChI=1S/C13H15Cl2N3/c1-13(2,3)9-6-8-10(15)4-7(14)5-11(8)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyZNISYSFZDZTVJV-UHFFFAOYSA-N
XLogP4.12
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 54.12
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

(3-tert-butyl-5,8-dichloro-6-methylquinolin-2-yl)hydrazine
CID 113445996
3-tert-butyl-5-chloro-N-ethyl-7-fluoroquinolin-2-amine
CID 107370729
(3-tert-butyl-5,6,8-trifluoroquinolin-2-yl)hydrazine
CID 63386017
5,7-dichloro-3-ethyl-N-methylquinolin-2-amine
CID 63531730
(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine
CID 63482793
(5-chloro-7-fluoro-3-propylquinolin-2-yl)hydrazine
CID 107370736
(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine
CID 63386142
(3-tert-butyl-7,8,9,10-tetrahydrobenzo[h]quinolin-2-yl)hydrazine
CID 63386139
2,3,6,7-tetrachloroquinoxaline;(3,6,7-trichloroquinoxalin-2-yl)hydrazine
CID 157221918
(7-chloro-2-cyclopropylquinazolin-4-yl)hydrazine
CID 106583896
[6,7-dichloro-3-(trifluoromethyl)quinoxalin-2-yl]hydrazine
CID 3410226
(7-chloro-2-propylquinazolin-4-yl)hydrazine
CID 106583898

Frequently Asked Questions

What is the IUPAC name of (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine?
The IUPAC name of (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine (CID 63386184) is (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine.
What is the SMILES notation for (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine?
The canonical SMILES for (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine is CC(C)(C)c1cc2c(Cl)cc(Cl)cc2nc1NN.
What is the InChIKey of (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine?
The InChIKey is ZNISYSFZDZTVJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c1-13(2,3)9-6-8-10(15)4-7(14)5-11(8)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18).
What are the key properties of (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine?
(3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine has a molecular weight of 284.19 g/mol, XLogP of 4.12, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-tert-butyl-5,7-dichloroquinolin-2-yl)hydrazine is sourced from PubChem (CID 63386184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).