5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine

C11H20N2 — CID 163948972

IUPAC5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine
SMILESCC1CC(C)(C2=CCCC2)N(C)N1
InChIInChI=1S/C11H20N2/c1-9-8-11(2,13(3)12-9)10-6-4-5-7-10/h6,9,12H,4-5,7-8H2,1-3H3
InChIKeyRXPSWIJISPMTDS-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.08
Rot. Bonds1

About 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine

5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine (PubChem CID 163948972) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine.

Molecular Properties

Compound Name5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine
PubChem CID163948972
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine
SMILESCC1CC(C)(C2=CCCC2)N(C)N1
InChIInChI=1S/C11H20N2/c1-9-8-11(2,13(3)12-9)10-6-4-5-7-10/h6,9,12H,4-5,7-8H2,1-3H3
InChIKeyRXPSWIJISPMTDS-UHFFFAOYSA-N
XLogP2.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine?
The IUPAC name of 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine (CID 163948972) is 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine.
What is the SMILES notation for 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine?
The canonical SMILES for 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine is CC1CC(C)(C2=CCCC2)N(C)N1.
What is the InChIKey of 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine?
The InChIKey is RXPSWIJISPMTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-9-8-11(2,13(3)12-9)10-6-4-5-7-10/h6,9,12H,4-5,7-8H2,1-3H3.
What are the key properties of 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine?
5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine has a molecular weight of 180.29 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopenten-1-yl)-1,3,5-trimethylpyrazolidine is sourced from PubChem (CID 163948972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).