[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine

C15H25FN4 — CID 105260291

IUPAC[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
SMILESCc1cc(F)cc(C(CC2CN(C)CCN2C)NN)c1
InChIInChI=1S/C15H25FN4/c1-11-6-12(8-13(16)7-11)15(18-17)9-14-10-19(2)4-5-20(14)3/h6-8,14-15,18H,4-5,9-10,17H2,1-3H3
InChIKeyVATVTGNLGDCOMC-UHFFFAOYSA-N
MW280.39 g/mol
LogP1.27
Rot. Bonds4

About [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine

[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine (PubChem CID 105260291) has the molecular formula C15H25FN4 and a molecular weight of 280.39 g/mol. Its IUPAC name is [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
PubChem CID105260291
Molecular FormulaC15H25FN4
Molecular Weight280.39 g/mol
Exact Mass280.21
IUPAC Name[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
SMILESCc1cc(F)cc(C(CC2CN(C)CCN2C)NN)c1
InChIInChI=1S/C15H25FN4/c1-11-6-12(8-13(16)7-11)15(18-17)9-14-10-19(2)4-5-20(14)3/h6-8,14-15,18H,4-5,9-10,17H2,1-3H3
InChIKeyVATVTGNLGDCOMC-UHFFFAOYSA-N
XLogP1.27
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.27
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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Frequently Asked Questions

What is the IUPAC name of [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine (CID 105260291) is [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine is Cc1cc(F)cc(C(CC2CN(C)CCN2C)NN)c1.
What is the InChIKey of [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine?
The InChIKey is VATVTGNLGDCOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FN4/c1-11-6-12(8-13(16)7-11)15(18-17)9-14-10-19(2)4-5-20(14)3/h6-8,14-15,18H,4-5,9-10,17H2,1-3H3.
What are the key properties of [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine?
[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine has a molecular weight of 280.39 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105260291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).