[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine

C14H23F3N4 — CID 105291456

IUPAC[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
SMILESCCn1cc(CC(NN)C2CCCCC2C(F)(F)F)cn1
InChIInChI=1S/C14H23F3N4/c1-2-21-9-10(8-19-21)7-13(20-18)11-5-3-4-6-12(11)14(15,16)17/h8-9,11-13,20H,2-7,18H2,1H3
InChIKeyPRTRGUKTIIAGGA-UHFFFAOYSA-N
MW304.36 g/mol
LogP2.65
Rot. Bonds5

About [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine

[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine (PubChem CID 105291456) has the molecular formula C14H23F3N4 and a molecular weight of 304.36 g/mol. Its IUPAC name is [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
PubChem CID105291456
Molecular FormulaC14H23F3N4
Molecular Weight304.36 g/mol
Exact Mass304.19
IUPAC Name[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine
SMILESCCn1cc(CC(NN)C2CCCCC2C(F)(F)F)cn1
InChIInChI=1S/C14H23F3N4/c1-2-21-9-10(8-19-21)7-13(20-18)11-5-3-4-6-12(11)14(15,16)17/h8-9,11-13,20H,2-7,18H2,1H3
InChIKeyPRTRGUKTIIAGGA-UHFFFAOYSA-N
XLogP2.65
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 52.65
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-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine?
The IUPAC name of [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine (CID 105291456) is [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine.
What is the SMILES notation for [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine?
The canonical SMILES for [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine is CCn1cc(CC(NN)C2CCCCC2C(F)(F)F)cn1.
What is the InChIKey of [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine?
The InChIKey is PRTRGUKTIIAGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N4/c1-2-21-9-10(8-19-21)7-13(20-18)11-5-3-4-6-12(11)14(15,16)17/h8-9,11-13,20H,2-7,18H2,1H3.
What are the key properties of [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine?
[2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine has a molecular weight of 304.36 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-ethylpyrazol-4-yl)-1-[2-(trifluoromethyl)cyclohexyl]ethyl]hydrazine is sourced from PubChem (CID 105291456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).