3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine

C13H26N2 — CID 19784804

IUPAC3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine
SMILESCC1CCN(CCCN2CCC(C)C2)C1
InChIInChI=1S/C13H26N2/c1-12-4-8-14(10-12)6-3-7-15-9-5-13(2)11-15/h12-13H,3-11H2,1-2H3
InChIKeyJSFSIQWVRIGBLS-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.06
Rot. Bonds4

About 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine

3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine (PubChem CID 19784804) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine.

Molecular Properties

Compound Name3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine
PubChem CID19784804
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine
SMILESCC1CCN(CCCN2CCC(C)C2)C1
InChIInChI=1S/C13H26N2/c1-12-4-8-14(10-12)6-3-7-15-9-5-13(2)11-15/h12-13H,3-11H2,1-2H3
InChIKeyJSFSIQWVRIGBLS-UHFFFAOYSA-N
XLogP2.06
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine?
The IUPAC name of 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine (CID 19784804) is 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine.
What is the SMILES notation for 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine?
The canonical SMILES for 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine is CC1CCN(CCCN2CCC(C)C2)C1.
What is the InChIKey of 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine?
The InChIKey is JSFSIQWVRIGBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-12-4-8-14(10-12)6-3-7-15-9-5-13(2)11-15/h12-13H,3-11H2,1-2H3.
What are the key properties of 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine?
3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine has a molecular weight of 210.36 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[3-(3-methylpyrrolidin-1-yl)propyl]pyrrolidine is sourced from PubChem (CID 19784804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).