2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine

C10H20N2 — CID 71669027

IUPAC2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine
SMILESCC1(C)NCCC1N1CCCC1
InChIInChI=1S/C10H20N2/c1-10(2)9(5-6-11-10)12-7-3-4-8-12/h9,11H,3-8H2,1-2H3
InChIKeyGXPUFRLBSDDRHW-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.22
Rot. Bonds1

About 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine

2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine (PubChem CID 71669027) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine.

Molecular Properties

Compound Name2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine
PubChem CID71669027
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine
SMILESCC1(C)NCCC1N1CCCC1
InChIInChI=1S/C10H20N2/c1-10(2)9(5-6-11-10)12-7-3-4-8-12/h9,11H,3-8H2,1-2H3
InChIKeyGXPUFRLBSDDRHW-UHFFFAOYSA-N
XLogP1.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine?
The IUPAC name of 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine (CID 71669027) is 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine.
What is the SMILES notation for 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine?
The canonical SMILES for 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine is CC1(C)NCCC1N1CCCC1.
What is the InChIKey of 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine?
The InChIKey is GXPUFRLBSDDRHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-10(2)9(5-6-11-10)12-7-3-4-8-12/h9,11H,3-8H2,1-2H3.
What are the key properties of 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine?
2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine has a molecular weight of 168.28 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-pyrrolidin-1-ylpyrrolidine is sourced from PubChem (CID 71669027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).