[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine

C14H27N3 — CID 105242911

IUPAC[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine
SMILESCC(C)=CC(NN)C1(N2CCCC2)CCCC1
InChIInChI=1S/C14H27N3/c1-12(2)11-13(16-15)14(7-3-4-8-14)17-9-5-6-10-17/h11,13,16H,3-10,15H2,1-2H3
InChIKeyGNLDBDYIFWYGRU-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.19
Rot. Bonds4

About [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine

[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine (PubChem CID 105242911) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine
PubChem CID105242911
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine
SMILESCC(C)=CC(NN)C1(N2CCCC2)CCCC1
InChIInChI=1S/C14H27N3/c1-12(2)11-13(16-15)14(7-3-4-8-14)17-9-5-6-10-17/h11,13,16H,3-10,15H2,1-2H3
InChIKeyGNLDBDYIFWYGRU-UHFFFAOYSA-N
XLogP2.19
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine?
The IUPAC name of [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine (CID 105242911) is [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine.
What is the SMILES notation for [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine?
The canonical SMILES for [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine is CC(C)=CC(NN)C1(N2CCCC2)CCCC1.
What is the InChIKey of [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine?
The InChIKey is GNLDBDYIFWYGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-12(2)11-13(16-15)14(7-3-4-8-14)17-9-5-6-10-17/h11,13,16H,3-10,15H2,1-2H3.
What are the key properties of [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine?
[3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine has a molecular weight of 237.39 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(1-pyrrolidin-1-ylcyclopentyl)but-2-enyl]hydrazine is sourced from PubChem (CID 105242911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).