[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

C15H18BrN3 — CID 105268027

IUPAC[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ncccc2Br)c1
InChIInChI=1S/C15H18BrN3/c1-10-6-11(2)8-12(7-10)9-14(19-17)15-13(16)4-3-5-18-15/h3-8,14,19H,9,17H2,1-2H3
InChIKeyXYKDXPWLIMQEGK-UHFFFAOYSA-N
MW320.23 g/mol
LogP3.21
Rot. Bonds4

About [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 105268027) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
PubChem CID105268027
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ncccc2Br)c1
InChIInChI=1S/C15H18BrN3/c1-10-6-11(2)8-12(7-10)9-14(19-17)15-13(16)4-3-5-18-15/h3-8,14,19H,9,17H2,1-2H3
InChIKeyXYKDXPWLIMQEGK-UHFFFAOYSA-N
XLogP3.21
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 53.21
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

[2-(3,5-dimethylphenyl)-1-(3-fluoro-2-pyridinyl)ethyl]hydrazine
CID 105257773
[1-(3-bromo-2-pyridinyl)-2-(4-ethylphenyl)ethyl]hydrazine
CID 105267953
[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105268203
[1-(3-bromo-2-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105268064
[1-(3-bromo-2-pyridinyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105268167
1-(3-bromo-2-pyridinyl)-N-methyl-2-pyridin-4-ylethanamine
CID 113398487
[2-(3-bromo-2,6-difluorophenyl)-1-(3-bromo-2-pyridinyl)ethyl]hydrazine
CID 106271188
3-[2-(3-bromo-2-pyridinyl)-2-hydrazinylethyl]pyridin-4-amine
CID 105268247
[1-(3-methyl-2-pyridinyl)-2-pyridin-4-ylethyl]hydrazine
CID 105209330
1-(3-bromo-2-pyridinyl)pent-4-enylhydrazine
CID 105268068
[2-(3,5-dimethylphenyl)-1-(6-methyl-3-pyridinyl)ethyl]hydrazine
CID 105212680
[2-(3,5-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine
CID 105212586

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (CID 105268027) is [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is Cc1cc(C)cc(CC(NN)c2ncccc2Br)c1.
What is the InChIKey of [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is XYKDXPWLIMQEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-10-6-11(2)8-12(7-10)9-14(19-17)15-13(16)4-3-5-18-15/h3-8,14,19H,9,17H2,1-2H3.
What are the key properties of [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
[1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 320.23 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-2-pyridinyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105268027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).