2-[(Z)-pent-1-enyl]pyrrolidine

C9H17N — CID 55300671

IUPAC2-[(Z)-pent-1-enyl]pyrrolidine
SMILESCCC/C=C\C1CCCN1
InChIInChI=1S/C9H17N/c1-2-3-4-6-9-7-5-8-10-9/h4,6,9-10H,2-3,5,7-8H2,1H3/b6-4-
InChIKeyXIVXNLABAPXPKT-XQRVVYSFSA-N
MW139.24 g/mol
LogP2.09
Rot. Bonds3

About 2-[(Z)-pent-1-enyl]pyrrolidine

2-[(Z)-pent-1-enyl]pyrrolidine (PubChem CID 55300671) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 2-[(Z)-pent-1-enyl]pyrrolidine.

Molecular Properties

Compound Name2-[(Z)-pent-1-enyl]pyrrolidine
PubChem CID55300671
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name2-[(Z)-pent-1-enyl]pyrrolidine
SMILESCCC/C=C\C1CCCN1
InChIInChI=1S/C9H17N/c1-2-3-4-6-9-7-5-8-10-9/h4,6,9-10H,2-3,5,7-8H2,1H3/b6-4-
InChIKeyXIVXNLABAPXPKT-XQRVVYSFSA-N
XLogP2.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-pent-1-enyl]pyrrolidine?
The IUPAC name of 2-[(Z)-pent-1-enyl]pyrrolidine (CID 55300671) is 2-[(Z)-pent-1-enyl]pyrrolidine.
What is the SMILES notation for 2-[(Z)-pent-1-enyl]pyrrolidine?
The canonical SMILES for 2-[(Z)-pent-1-enyl]pyrrolidine is CCC/C=C\C1CCCN1.
What is the InChIKey of 2-[(Z)-pent-1-enyl]pyrrolidine?
The InChIKey is XIVXNLABAPXPKT-XQRVVYSFSA-N. The full InChI is InChI=1S/C9H17N/c1-2-3-4-6-9-7-5-8-10-9/h4,6,9-10H,2-3,5,7-8H2,1H3/b6-4-.
What are the key properties of 2-[(Z)-pent-1-enyl]pyrrolidine?
2-[(Z)-pent-1-enyl]pyrrolidine has a molecular weight of 139.24 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-pent-1-enyl]pyrrolidine is sourced from PubChem (CID 55300671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).