(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine

C11H10BrF2N3 — CID 107616905

IUPAC(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine
SMILESCc1nc2c(F)cc(Br)c(F)c2c(NN)c1C
InChIInChI=1S/C11H10BrF2N3/c1-4-5(2)16-11-7(13)3-6(12)9(14)8(11)10(4)17-15/h3H,15H2,1-2H3,(H,16,17)
InChIKeyZPHXYCVNUSWZDX-UHFFFAOYSA-N
MW302.12 g/mol
LogP3.18
Rot. Bonds1

About (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine

(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine (PubChem CID 107616905) has the molecular formula C11H10BrF2N3 and a molecular weight of 302.12 g/mol. Its IUPAC name is (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine
PubChem CID107616905
Molecular FormulaC11H10BrF2N3
Molecular Weight302.12 g/mol
Exact Mass301.00
IUPAC Name(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine
SMILESCc1nc2c(F)cc(Br)c(F)c2c(NN)c1C
InChIInChI=1S/C11H10BrF2N3/c1-4-5(2)16-11-7(13)3-6(12)9(14)8(11)10(4)17-15/h3H,15H2,1-2H3,(H,16,17)
InChIKeyZPHXYCVNUSWZDX-UHFFFAOYSA-N
XLogP3.18
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.12
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5,6,8-trifluoro-2,3-dimethylquinolin-4-yl)hydrazine
CID 62809377
(5,6,8-trifluoro-2-methyl-3-propan-2-ylquinolin-4-yl)hydrazine
CID 62915682
(8-fluoro-2,3,5-trimethylquinolin-4-yl)hydrazine
CID 62252075
(5,7-difluoro-2,3-dimethylquinolin-4-yl)hydrazine
CID 62250577
(5-bromo-3-ethyl-8-fluoro-2-methylquinolin-4-yl)hydrazine
CID 62250940
5,8-difluoro-2,3,6-trimethyl-N-propylquinolin-4-amine
CID 103587346
7-bromo-5,8-difluoro-N-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 107616780
(6-bromo-5,8-difluoroquinolin-4-yl)hydrazine
CID 107616888
5,6,8-trifluoro-N,2-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62915678
6-bromo-2,4-dichloro-5,8-difluoroquinazoline
CID 176948856
[6-bromo-7-fluoro-3-methyl-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 103996968
[5-fluoro-3,8-dimethyl-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 63744433

Frequently Asked Questions

What is the IUPAC name of (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine?
The IUPAC name of (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine (CID 107616905) is (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine.
What is the SMILES notation for (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine?
The canonical SMILES for (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine is Cc1nc2c(F)cc(Br)c(F)c2c(NN)c1C.
What is the InChIKey of (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine?
The InChIKey is ZPHXYCVNUSWZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrF2N3/c1-4-5(2)16-11-7(13)3-6(12)9(14)8(11)10(4)17-15/h3H,15H2,1-2H3,(H,16,17).
What are the key properties of (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine?
(6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine has a molecular weight of 302.12 g/mol, XLogP of 3.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-5,8-difluoro-2,3-dimethylquinolin-4-yl)hydrazine is sourced from PubChem (CID 107616905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).