1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine

C9H16N2O — CID 105198651

IUPAC1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine
SMILESC#CCC(CC1CCCO1)NN
InChIInChI=1S/C9H16N2O/c1-2-4-8(11-10)7-9-5-3-6-12-9/h1,8-9,11H,3-7,10H2
InChIKeyQYAGPFMONIYTDV-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.41
Rot. Bonds4

About 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine

1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine (PubChem CID 105198651) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine.

Molecular Properties

Compound Name1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine
PubChem CID105198651
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine
SMILESC#CCC(CC1CCCO1)NN
InChIInChI=1S/C9H16N2O/c1-2-4-8(11-10)7-9-5-3-6-12-9/h1,8-9,11H,3-7,10H2
InChIKeyQYAGPFMONIYTDV-UHFFFAOYSA-N
XLogP0.41
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine?
The IUPAC name of 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine (CID 105198651) is 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine.
What is the SMILES notation for 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine?
The canonical SMILES for 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine is C#CCC(CC1CCCO1)NN.
What is the InChIKey of 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine?
The InChIKey is QYAGPFMONIYTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-2-4-8(11-10)7-9-5-3-6-12-9/h1,8-9,11H,3-7,10H2.
What are the key properties of 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine?
1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine has a molecular weight of 168.24 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)pent-4-yn-2-ylhydrazine is sourced from PubChem (CID 105198651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).