[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine

C9H15F3N4 — CID 105313929

IUPAC[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine
SMILESCc1cc(C(CCC(F)(F)F)NN)n(C)n1
InChIInChI=1S/C9H15F3N4/c1-6-5-8(16(2)15-6)7(14-13)3-4-9(10,11)12/h5,7,14H,3-4,13H2,1-2H3
InChIKeyBCGGNIGIVALIKV-UHFFFAOYSA-N
MW236.24 g/mol
LogP1.58
Rot. Bonds4

About [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine

[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine (PubChem CID 105313929) has the molecular formula C9H15F3N4 and a molecular weight of 236.24 g/mol. Its IUPAC name is [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine
PubChem CID105313929
Molecular FormulaC9H15F3N4
Molecular Weight236.24 g/mol
Exact Mass236.12
IUPAC Name[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine
SMILESCc1cc(C(CCC(F)(F)F)NN)n(C)n1
InChIInChI=1S/C9H15F3N4/c1-6-5-8(16(2)15-6)7(14-13)3-4-9(10,11)12/h5,7,14H,3-4,13H2,1-2H3
InChIKeyBCGGNIGIVALIKV-UHFFFAOYSA-N
XLogP1.58
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 51.58
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'}

Analyze [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]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

1-(2,5-dimethylpyrazol-3-yl)octylhydrazine
CID 105293599
[2-cyclopentyl-1-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105299111
N-ethyl-1-(2-ethyl-5-methylpyrazol-3-yl)-4,4,4-trifluorobutan-1-amine
CID 105156471
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105316011
[2-(5-bromo-3-pyridinyl)-1-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105334796
[(2,5-dimethylpyrazol-3-yl)-[3-fluoro-4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107292483
3-amino-1-(2,5-dimethylpyrazol-3-yl)propan-1-ol
CID 82598009
[4,4,4-trifluoro-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105313895
3-cyclohexyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
CID 114192965
2-(2,5-dimethylpyrazol-3-yl)-3,3,3-trifluoro-N-methylpropan-1-amine
CID 83917687
1-(2,5-dimethylpyrazol-3-yl)-N-methylpentan-1-amine
CID 105125646
3-cyclopropyl-1-(2,5-dimethylpyrazol-3-yl)-N-methylpropan-1-amine
CID 105157885

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine?
The IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine (CID 105313929) is [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine.
What is the SMILES notation for [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine?
The canonical SMILES for [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine is Cc1cc(C(CCC(F)(F)F)NN)n(C)n1.
What is the InChIKey of [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine?
The InChIKey is BCGGNIGIVALIKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N4/c1-6-5-8(16(2)15-6)7(14-13)3-4-9(10,11)12/h5,7,14H,3-4,13H2,1-2H3.
What are the key properties of [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine?
[1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine has a molecular weight of 236.24 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylpyrazol-3-yl)-4,4,4-trifluorobutyl]hydrazine is sourced from PubChem (CID 105313929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).