3-tert-butyl-2,5-dimethylidenepyrrolidine

C10H17N — CID 129153487

IUPAC3-tert-butyl-2,5-dimethylidenepyrrolidine
SMILESC=C1CC(C(C)(C)C)C(=C)N1
InChIInChI=1S/C10H17N/c1-7-6-9(8(2)11-7)10(3,4)5/h9,11H,1-2,6H2,3-5H3
InChIKeyOOMXCXGTVUEFMO-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.67
Rot. Bonds

About 3-tert-butyl-2,5-dimethylidenepyrrolidine

3-tert-butyl-2,5-dimethylidenepyrrolidine (PubChem CID 129153487) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3-tert-butyl-2,5-dimethylidenepyrrolidine.

Molecular Properties

Compound Name3-tert-butyl-2,5-dimethylidenepyrrolidine
PubChem CID129153487
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3-tert-butyl-2,5-dimethylidenepyrrolidine
SMILESC=C1CC(C(C)(C)C)C(=C)N1
InChIInChI=1S/C10H17N/c1-7-6-9(8(2)11-7)10(3,4)5/h9,11H,1-2,6H2,3-5H3
InChIKeyOOMXCXGTVUEFMO-UHFFFAOYSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-2,5-dimethylidenepyrrolidine?
The IUPAC name of 3-tert-butyl-2,5-dimethylidenepyrrolidine (CID 129153487) is 3-tert-butyl-2,5-dimethylidenepyrrolidine.
What is the SMILES notation for 3-tert-butyl-2,5-dimethylidenepyrrolidine?
The canonical SMILES for 3-tert-butyl-2,5-dimethylidenepyrrolidine is C=C1CC(C(C)(C)C)C(=C)N1.
What is the InChIKey of 3-tert-butyl-2,5-dimethylidenepyrrolidine?
The InChIKey is OOMXCXGTVUEFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-7-6-9(8(2)11-7)10(3,4)5/h9,11H,1-2,6H2,3-5H3.
What are the key properties of 3-tert-butyl-2,5-dimethylidenepyrrolidine?
3-tert-butyl-2,5-dimethylidenepyrrolidine has a molecular weight of 151.25 g/mol, XLogP of 2.67, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-2,5-dimethylidenepyrrolidine is sourced from PubChem (CID 129153487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).