2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine

C10H20FN — CID 131015142

IUPAC2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine
SMILESCCC(C)C(C)(F)C1CCCN1
InChIInChI=1S/C10H20FN/c1-4-8(2)10(3,11)9-6-5-7-12-9/h8-9,12H,4-7H2,1-3H3
InChIKeyWIJIWCZSSFKENI-UHFFFAOYSA-N
MW173.27 g/mol
LogP2.51
Rot. Bonds3

About 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine

2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine (PubChem CID 131015142) has the molecular formula C10H20FN and a molecular weight of 173.27 g/mol. Its IUPAC name is 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine.

Molecular Properties

Compound Name2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine
PubChem CID131015142
Molecular FormulaC10H20FN
Molecular Weight173.27 g/mol
Exact Mass173.16
IUPAC Name2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine
SMILESCCC(C)C(C)(F)C1CCCN1
InChIInChI=1S/C10H20FN/c1-4-8(2)10(3,11)9-6-5-7-12-9/h8-9,12H,4-7H2,1-3H3
InChIKeyWIJIWCZSSFKENI-UHFFFAOYSA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine?
The IUPAC name of 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine (CID 131015142) is 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine.
What is the SMILES notation for 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine?
The canonical SMILES for 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine is CCC(C)C(C)(F)C1CCCN1.
What is the InChIKey of 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine?
The InChIKey is WIJIWCZSSFKENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-4-8(2)10(3,11)9-6-5-7-12-9/h8-9,12H,4-7H2,1-3H3.
What are the key properties of 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine?
2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine has a molecular weight of 173.27 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methylpentan-2-yl)pyrrolidine is sourced from PubChem (CID 131015142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).