(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine

C13H15Br2N3 — CID 63386142

IUPAC(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine
SMILESCC(C)(C)c1cc2cc(Br)cc(Br)c2nc1NN
InChIInChI=1S/C13H15Br2N3/c1-13(2,3)9-5-7-4-8(14)6-10(15)11(7)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyMIKFRBWKBFSWQB-UHFFFAOYSA-N
MW373.09 g/mol
LogP4.34
Rot. Bonds1

About (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine

(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine (PubChem CID 63386142) has the molecular formula C13H15Br2N3 and a molecular weight of 373.09 g/mol. Its IUPAC name is (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine.

Molecular Properties

Compound Name(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine
PubChem CID63386142
Molecular FormulaC13H15Br2N3
Molecular Weight373.09 g/mol
Exact Mass370.96
IUPAC Name(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine
SMILESCC(C)(C)c1cc2cc(Br)cc(Br)c2nc1NN
InChIInChI=1S/C13H15Br2N3/c1-13(2,3)9-5-7-4-8(14)6-10(15)11(7)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18)
InChIKeyMIKFRBWKBFSWQB-UHFFFAOYSA-N
XLogP4.34
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.09
LogP ≤ 54.34
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

CID 17039634
CID 17039634
CID 103997006
CID 103997006
CID 63232762
CID 63232762
CID 84628746
CID 84628746
CID 103997013
CID 103997013
CID 55183109
CID 55183109
CID 55183830
CID 55183830
CID 55229166
CID 55229166
CID 63232266
CID 63232266
CID 63232267
CID 63232267
CID 63232268
CID 63232268
CID 63232269
CID 63232269

Frequently Asked Questions

What is the IUPAC name of (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine?
The IUPAC name of (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine (CID 63386142) is (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine.
What is the SMILES notation for (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine?
The canonical SMILES for (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine is CC(C)(C)c1cc2cc(Br)cc(Br)c2nc1NN.
What is the InChIKey of (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine?
The InChIKey is MIKFRBWKBFSWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Br2N3/c1-13(2,3)9-5-7-4-8(14)6-10(15)11(7)17-12(9)18-16/h4-6H,16H2,1-3H3,(H,17,18).
What are the key properties of (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine?
(6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine has a molecular weight of 373.09 g/mol, XLogP of 4.34, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6,8-dibromo-3-tert-butylquinolin-2-yl)hydrazine is sourced from PubChem (CID 63386142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).