4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine

C10H19FN2 — CID 138569410

IUPAC4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine
SMILESCN1CCC(C2CC(F)CN2C)C1
InChIInChI=1S/C10H19FN2/c1-12-4-3-8(6-12)10-5-9(11)7-13(10)2/h8-10H,3-7H2,1-2H3
InChIKeyRXVAYTGEOMJSFH-UHFFFAOYSA-N
MW186.27 g/mol
LogP0.98
Rot. Bonds1

About 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine

4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine (PubChem CID 138569410) has the molecular formula C10H19FN2 and a molecular weight of 186.27 g/mol. Its IUPAC name is 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine.

Molecular Properties

Compound Name4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine
PubChem CID138569410
Molecular FormulaC10H19FN2
Molecular Weight186.27 g/mol
Exact Mass186.15
IUPAC Name4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine
SMILESCN1CCC(C2CC(F)CN2C)C1
InChIInChI=1S/C10H19FN2/c1-12-4-3-8(6-12)10-5-9(11)7-13(10)2/h8-10H,3-7H2,1-2H3
InChIKeyRXVAYTGEOMJSFH-UHFFFAOYSA-N
XLogP0.98
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine?
The IUPAC name of 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine (CID 138569410) is 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine.
What is the SMILES notation for 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine?
The canonical SMILES for 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine is CN1CCC(C2CC(F)CN2C)C1.
What is the InChIKey of 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine?
The InChIKey is RXVAYTGEOMJSFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2/c1-12-4-3-8(6-12)10-5-9(11)7-13(10)2/h8-10H,3-7H2,1-2H3.
What are the key properties of 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine?
4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine has a molecular weight of 186.27 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methyl-2-(1-methylpyrrolidin-3-yl)pyrrolidine is sourced from PubChem (CID 138569410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).