[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine

C15H20BrN3S — CID 105279404

IUPAC[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
SMILESCc1cc(C(Cc2nc(C)c(C)s2)NN)cc(C)c1Br
InChIInChI=1S/C15H20BrN3S/c1-8-5-12(6-9(2)15(8)16)13(19-17)7-14-18-10(3)11(4)20-14/h5-6,13,19H,7,17H2,1-4H3
InChIKeyYENBXWARZYPBOV-UHFFFAOYSA-N
MW354.32 g/mol
LogP3.89
Rot. Bonds4

About [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine

[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine (PubChem CID 105279404) has the molecular formula C15H20BrN3S and a molecular weight of 354.32 g/mol. Its IUPAC name is [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
PubChem CID105279404
Molecular FormulaC15H20BrN3S
Molecular Weight354.32 g/mol
Exact Mass353.06
IUPAC Name[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
SMILESCc1cc(C(Cc2nc(C)c(C)s2)NN)cc(C)c1Br
InChIInChI=1S/C15H20BrN3S/c1-8-5-12(6-9(2)15(8)16)13(19-17)7-14-18-10(3)11(4)20-14/h5-6,13,19H,7,17H2,1-4H3
InChIKeyYENBXWARZYPBOV-UHFFFAOYSA-N
XLogP3.89
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.32
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[1-(4-bromophenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105192292
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-phenylethyl]hydrazine
CID 105199172
[1-(2,5-dibromothiophen-3-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 107970504
[1-(2,5-dichlorothiophen-3-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 107970503
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105326726
[1-(4-bromo-3,5-dimethylphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105279428
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105326755
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
CID 105326798
[1-(4-bromo-3,5-dimethylphenyl)-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 105279419
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinolin-2-ylethyl]hydrazine
CID 105218619
[1-(3,5-dibromophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 107979313
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinoxalin-2-ylethyl]hydrazine
CID 107357927

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine (CID 105279404) is [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine is Cc1cc(C(Cc2nc(C)c(C)s2)NN)cc(C)c1Br.
What is the InChIKey of [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine?
The InChIKey is YENBXWARZYPBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrN3S/c1-8-5-12(6-9(2)15(8)16)13(19-17)7-14-18-10(3)11(4)20-14/h5-6,13,19H,7,17H2,1-4H3.
What are the key properties of [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine?
[1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine has a molecular weight of 354.32 g/mol, XLogP of 3.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-3,5-dimethylphenyl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105279404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).