4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine

C7H15FN2 — CID 163647710

IUPAC4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine
SMILESCCC1(F)CNC(NC)C1
InChIInChI=1S/C7H15FN2/c1-3-7(8)4-6(9-2)10-5-7/h6,9-10H,3-5H2,1-2H3
InChIKeyIJQYCJPUCXIOMG-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.64
Rot. Bonds2

About 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine

4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine (PubChem CID 163647710) has the molecular formula C7H15FN2 and a molecular weight of 146.21 g/mol. Its IUPAC name is 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine.

Molecular Properties

Compound Name4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine
PubChem CID163647710
Molecular FormulaC7H15FN2
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine
SMILESCCC1(F)CNC(NC)C1
InChIInChI=1S/C7H15FN2/c1-3-7(8)4-6(9-2)10-5-7/h6,9-10H,3-5H2,1-2H3
InChIKeyIJQYCJPUCXIOMG-UHFFFAOYSA-N
XLogP0.64
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine?
The IUPAC name of 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine (CID 163647710) is 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine.
What is the SMILES notation for 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine?
The canonical SMILES for 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine is CCC1(F)CNC(NC)C1.
What is the InChIKey of 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine?
The InChIKey is IJQYCJPUCXIOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2/c1-3-7(8)4-6(9-2)10-5-7/h6,9-10H,3-5H2,1-2H3.
What are the key properties of 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine?
4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine has a molecular weight of 146.21 g/mol, XLogP of 0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-fluoro-N-methylpyrrolidin-2-amine is sourced from PubChem (CID 163647710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).