[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

C15H22FN5 — CID 105258715

IUPAC[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCC(CC)n1ccc(CC(NN)c2ccncc2F)n1
InChIInChI=1S/C15H22FN5/c1-3-12(4-2)21-8-6-11(20-21)9-15(19-17)13-5-7-18-10-14(13)16/h5-8,10,12,15,19H,3-4,9,17H2,1-2H3
InChIKeyOPIYTLLQCXRHEE-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.53
Rot. Bonds7

About [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105258715) has the molecular formula C15H22FN5 and a molecular weight of 291.37 g/mol. Its IUPAC name is [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105258715
Molecular FormulaC15H22FN5
Molecular Weight291.37 g/mol
Exact Mass291.19
IUPAC Name[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCC(CC)n1ccc(CC(NN)c2ccncc2F)n1
InChIInChI=1S/C15H22FN5/c1-3-12(4-2)21-8-6-11(20-21)9-15(19-17)13-5-7-18-10-14(13)16/h5-8,10,12,15,19H,3-4,9,17H2,1-2H3
InChIKeyOPIYTLLQCXRHEE-UHFFFAOYSA-N
XLogP2.53
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (CID 105258715) is [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is CCC(CC)n1ccc(CC(NN)c2ccncc2F)n1.
What is the InChIKey of [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is OPIYTLLQCXRHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN5/c1-3-12(4-2)21-8-6-11(20-21)9-15(19-17)13-5-7-18-10-14(13)16/h5-8,10,12,15,19H,3-4,9,17H2,1-2H3.
What are the key properties of [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
[1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 291.37 g/mol, XLogP of 2.53, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-4-pyridinyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105258715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).