2-tert-butyl-1-ethenylpyrrolidine

C10H19N — CID 126620960

IUPAC2-tert-butyl-1-ethenylpyrrolidine
SMILESC=CN1CCCC1C(C)(C)C
InChIInChI=1S/C10H19N/c1-5-11-8-6-7-9(11)10(2,3)4/h5,9H,1,6-8H2,2-4H3
InChIKeyDHXVFZYULNAPPS-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.64
Rot. Bonds1

About 2-tert-butyl-1-ethenylpyrrolidine

2-tert-butyl-1-ethenylpyrrolidine (PubChem CID 126620960) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-tert-butyl-1-ethenylpyrrolidine.

Molecular Properties

Compound Name2-tert-butyl-1-ethenylpyrrolidine
PubChem CID126620960
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-tert-butyl-1-ethenylpyrrolidine
SMILESC=CN1CCCC1C(C)(C)C
InChIInChI=1S/C10H19N/c1-5-11-8-6-7-9(11)10(2,3)4/h5,9H,1,6-8H2,2-4H3
InChIKeyDHXVFZYULNAPPS-UHFFFAOYSA-N
XLogP2.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-tert-butyl-1-ethenylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-ethenylpyrrolidine?
The IUPAC name of 2-tert-butyl-1-ethenylpyrrolidine (CID 126620960) is 2-tert-butyl-1-ethenylpyrrolidine.
What is the SMILES notation for 2-tert-butyl-1-ethenylpyrrolidine?
The canonical SMILES for 2-tert-butyl-1-ethenylpyrrolidine is C=CN1CCCC1C(C)(C)C.
What is the InChIKey of 2-tert-butyl-1-ethenylpyrrolidine?
The InChIKey is DHXVFZYULNAPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-5-11-8-6-7-9(11)10(2,3)4/h5,9H,1,6-8H2,2-4H3.
What are the key properties of 2-tert-butyl-1-ethenylpyrrolidine?
2-tert-butyl-1-ethenylpyrrolidine has a molecular weight of 153.27 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-ethenylpyrrolidine is sourced from PubChem (CID 126620960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).