4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine

C8H14F3N5 — CID 105231133

IUPAC4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine
SMILESNNC(CCCC(F)(F)F)c1cn[nH]c1N
InChIInChI=1S/C8H14F3N5/c9-8(10,11)3-1-2-6(15-13)5-4-14-16-7(5)12/h4,6,15H,1-3,13H2,(H3,12,14,16)
InChIKeyJMARYKOPRMJOCG-UHFFFAOYSA-N
MW237.23 g/mol
LogP1.23
Rot. Bonds5

About 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine

4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine (PubChem CID 105231133) has the molecular formula C8H14F3N5 and a molecular weight of 237.23 g/mol. Its IUPAC name is 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine
PubChem CID105231133
Molecular FormulaC8H14F3N5
Molecular Weight237.23 g/mol
Exact Mass237.12
IUPAC Name4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine
SMILESNNC(CCCC(F)(F)F)c1cn[nH]c1N
InChIInChI=1S/C8H14F3N5/c9-8(10,11)3-1-2-6(15-13)5-4-14-16-7(5)12/h4,6,15H,1-3,13H2,(H3,12,14,16)
InChIKeyJMARYKOPRMJOCG-UHFFFAOYSA-N
XLogP1.23
TPSA92.75 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.23
LogP ≤ 51.23
H-Bond Donors ≤ 54
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 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine (CID 105231133) is 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine is NNC(CCCC(F)(F)F)c1cn[nH]c1N.
What is the InChIKey of 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine?
The InChIKey is JMARYKOPRMJOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3N5/c9-8(10,11)3-1-2-6(15-13)5-4-14-16-7(5)12/h4,6,15H,1-3,13H2,(H3,12,14,16).
What are the key properties of 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine?
4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine has a molecular weight of 237.23 g/mol, XLogP of 1.23, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,5,5-trifluoro-1-hydrazinylpentyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 105231133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).