pent-1-en-3-ylhydrazine

C5H12N2 — CID 55280954

IUPACpent-1-en-3-ylhydrazine
SMILESC=CC(CC)NN
InChIInChI=1S/C5H12N2/c1-3-5(4-2)7-6/h3,5,7H,1,4,6H2,2H3
InChIKeyFCPDWDIIAARKOX-UHFFFAOYSA-N
MW100.16 g/mol
LogP0.41
Rot. Bonds3

About pent-1-en-3-ylhydrazine

pent-1-en-3-ylhydrazine (PubChem CID 55280954) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is pent-1-en-3-ylhydrazine.

Molecular Properties

Compound Namepent-1-en-3-ylhydrazine
PubChem CID55280954
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Namepent-1-en-3-ylhydrazine
SMILESC=CC(CC)NN
InChIInChI=1S/C5H12N2/c1-3-5(4-2)7-6/h3,5,7H,1,4,6H2,2H3
InChIKeyFCPDWDIIAARKOX-UHFFFAOYSA-N
XLogP0.41
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 pent-1-en-3-ylhydrazine?
The IUPAC name of pent-1-en-3-ylhydrazine (CID 55280954) is pent-1-en-3-ylhydrazine.
What is the SMILES notation for pent-1-en-3-ylhydrazine?
The canonical SMILES for pent-1-en-3-ylhydrazine is C=CC(CC)NN.
What is the InChIKey of pent-1-en-3-ylhydrazine?
The InChIKey is FCPDWDIIAARKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-3-5(4-2)7-6/h3,5,7H,1,4,6H2,2H3.
What are the key properties of pent-1-en-3-ylhydrazine?
pent-1-en-3-ylhydrazine has a molecular weight of 100.16 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pent-1-en-3-ylhydrazine is sourced from PubChem (CID 55280954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).