(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine

C13H15Cl2N3 — CID 63482793

IUPAC(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine
SMILESCC(C)(C)c1cc(NN)c2cc(Cl)cc(Cl)c2n1
InChIInChI=1S/C13H15Cl2N3/c1-13(2,3)11-6-10(18-16)8-4-7(14)5-9(15)12(8)17-11/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyXXQVJQFPRMIFQK-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.12
Rot. Bonds1

About (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine

(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine (PubChem CID 63482793) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine
PubChem CID63482793
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name(2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine
SMILESCC(C)(C)c1cc(NN)c2cc(Cl)cc(Cl)c2n1
InChIInChI=1S/C13H15Cl2N3/c1-13(2,3)11-6-10(18-16)8-4-7(14)5-9(15)12(8)17-11/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyXXQVJQFPRMIFQK-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

Acridine, 1,2,3,4-tetrahydro-9-amino-7-chloro-
CID 22493
Acridine, 9-amino-2-chloro-
CID 31756
5-Chloro-1,2,3,4-tetrahydro-acridin-9-ylamine
CID 44381944
8-Chloro-2-methylquinolin-4-amine
CID 12465494
6-Chloro-2-hydrazino-4-methylquinoline
CID 2565934
7-chloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;hydrochloride
CID 164610888
Acridine, 9-amino-4-chloro-
CID 31757
4-Amino-7,8-dichloro-2-methylquinoline
CID 17039646
N-(2-chlorophenyl)-2-methylquinolin-4-amine
CID 738401
5,7-Dichloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
CID 164615123
2-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine;hydrochloride
CID 164615871
2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine;hydrochloride
CID 164624345

Frequently Asked Questions

What is the IUPAC name of (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine?
The IUPAC name of (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine (CID 63482793) is (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine.
What is the SMILES notation for (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine?
The canonical SMILES for (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine is CC(C)(C)c1cc(NN)c2cc(Cl)cc(Cl)c2n1.
What is the InChIKey of (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine?
The InChIKey is XXQVJQFPRMIFQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c1-13(2,3)11-6-10(18-16)8-4-7(14)5-9(15)12(8)17-11/h4-6H,16H2,1-3H3,(H,17,18).
What are the key properties of (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine?
(2-tert-butyl-6,8-dichloroquinolin-4-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 (2-tert-butyl-6,8-dichloroquinolin-4-yl)hydrazine is sourced from PubChem (CID 63482793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).