[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine

C10H17F3N4 — CID 105248923

IUPAC[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
SMILESCCn1cc(CC(CCC(F)(F)F)NN)cn1
InChIInChI=1S/C10H17F3N4/c1-2-17-7-8(6-15-17)5-9(16-14)3-4-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3
InChIKeyKZIZKZLPOCBXJF-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.62
Rot. Bonds6

About [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine

[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine (PubChem CID 105248923) has the molecular formula C10H17F3N4 and a molecular weight of 250.27 g/mol. Its IUPAC name is [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
PubChem CID105248923
Molecular FormulaC10H17F3N4
Molecular Weight250.27 g/mol
Exact Mass250.14
IUPAC Name[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
SMILESCCn1cc(CC(CCC(F)(F)F)NN)cn1
InChIInChI=1S/C10H17F3N4/c1-2-17-7-8(6-15-17)5-9(16-14)3-4-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3
InChIKeyKZIZKZLPOCBXJF-UHFFFAOYSA-N
XLogP1.62
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.62
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

2-(1-methyl-1H-pyrazol-4-yl)piperidine
CID 63085164
alpha,1-Dimethyl-1H-pyrazole-4-ethanamine
CID 43199853
cyclobutyl(1-methyl-1H-pyrazol-4-yl)methanamine
CID 43124235
4-(1-methyl-1H-pyrazol-4-yl)butan-2-amine
CID 62127805
{[1-ethyl-2-(1-methyl-1H-pyrazol-4-yl)piperidin-3-yl]methyl}(methyl)amine
CID 64067740
1-methyl-4-[(pyrrolidin-2-yl)methyl]-1H-pyrazole
CID 64089898
1-(1-ethyl-1H-pyrazol-4-yl)propan-1-amine
CID 23005819
4-[3,3-Difluoro-3-(1-methylpyrazol-4-yl)propyl]piperidine
CID 18187752
2-[(1-Tert-butylpyrazol-4-yl)methyl]-5,5,5-trifluoro-2-isocyanopentanenitrile
CID 57736316
1-(2-Fluoroethyl)-4-pentylpyrazole
CID 69998690
3-Fluoro-4-[4-(2-methylpropyl)pyrazol-1-yl]piperidine
CID 70847466
1-(2,2-Difluoroethyl)-4-(3-methylbutyl)pyrazole
CID 118301783

Frequently Asked Questions

What is the IUPAC name of [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The IUPAC name of [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine (CID 105248923) is [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The canonical SMILES for [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine is CCn1cc(CC(CCC(F)(F)F)NN)cn1.
What is the InChIKey of [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
The InChIKey is KZIZKZLPOCBXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N4/c1-2-17-7-8(6-15-17)5-9(16-14)3-4-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3.
What are the key properties of [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine?
[1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine has a molecular weight of 250.27 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-ethylpyrazol-4-yl)-5,5,5-trifluoropentan-2-yl]hydrazine is sourced from PubChem (CID 105248923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).