4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine

C9H17N5 — CID 105231052

IUPAC4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine
SMILESC=CCCCC(NN)c1cn[nH]c1N
InChIInChI=1S/C9H17N5/c1-2-3-4-5-8(13-11)7-6-12-14-9(7)10/h2,6,8,13H,1,3-5,11H2,(H3,10,12,14)
InChIKeyROFXNICLRBBYBT-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.85
Rot. Bonds6

About 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine

4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine (PubChem CID 105231052) has the molecular formula C9H17N5 and a molecular weight of 195.27 g/mol. Its IUPAC name is 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine
PubChem CID105231052
Molecular FormulaC9H17N5
Molecular Weight195.27 g/mol
Exact Mass195.15
IUPAC Name4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine
SMILESC=CCCCC(NN)c1cn[nH]c1N
InChIInChI=1S/C9H17N5/c1-2-3-4-5-8(13-11)7-6-12-14-9(7)10/h2,6,8,13H,1,3-5,11H2,(H3,10,12,14)
InChIKeyROFXNICLRBBYBT-UHFFFAOYSA-N
XLogP0.85
TPSA92.75 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.85
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine (CID 105231052) is 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine is C=CCCCC(NN)c1cn[nH]c1N.
What is the InChIKey of 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine?
The InChIKey is ROFXNICLRBBYBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N5/c1-2-3-4-5-8(13-11)7-6-12-14-9(7)10/h2,6,8,13H,1,3-5,11H2,(H3,10,12,14).
What are the key properties of 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine?
4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine has a molecular weight of 195.27 g/mol, XLogP of 0.85, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydrazinylhex-5-enyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 105231052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).