[1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine

C₁₂H₂₁ClN₄ — CID 105338877

About [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine

[1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine (PubChem CID 105338877) has the molecular formula C₁₂H₂₁ClN₄ and a molecular weight of 256.78 g/mol. Its IUPAC name is [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine.

Molecular Properties

• Compound Name: [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine
• PubChem CID: 105338877
• Molecular Formula: C₁₂H₂₁ClN₄
• Molecular Weight: 256.78 g/mol
• Exact Mass: 256.15
• IUPAC Name: [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine
• SMILES: Cn1ncc(Cl)c1C(CCC1CCCC1)NN
• InChI: InChI=1S/C12H21ClN4/c1-17-12(10(13)8-15-17)11(16-14)7-6-9-4-2-3-5-9/h8-9,11,16H,2-7,14H2,1H3
• InChIKey: IKQVLJXZRIENNL-UHFFFAOYSA-N
• XLogP: 2.55
• TPSA: 55.87 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 17
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	256.78
LogP ≤ 5	2.55
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine?

The IUPAC name of [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine (CID 105338877) is [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine.

What is the SMILES notation for [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine?

The canonical SMILES for [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine is Cn1ncc(Cl)c1C(CCC1CCCC1)NN.

What is the InChIKey of [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine?

The InChIKey is IKQVLJXZRIENNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21ClN4/c1-17-12(10(13)8-15-17)11(16-14)7-6-9-4-2-3-5-9/h8-9,11,16H,2-7,14H2,1H3.

What are the key properties of [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine?

[1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine has a molecular weight of 256.78 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(4-chloro-1-methylpyrazol-5-yl)-3-cyclopentylpropyl]hydrazine is sourced from PubChem (CID 105338877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 105338877 — identifiers, structure, computed properties (public domain)

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