(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine

C11H22FNO — CID 139476962

IUPAC(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
SMILESCC(F)OCC1C[C@@H](C)N(C(C)C)C1
InChIInChI=1S/C11H22FNO/c1-8(2)13-6-11(5-9(13)3)7-14-10(4)12/h8-11H,5-7H2,1-4H3/t9-,10?,11?/m1/s1
InChIKeyBEGGSYUHXPWTKG-KPPDAEKUSA-N
MW203.30 g/mol
LogP2.44
Rot. Bonds4

About (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine

(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine (PubChem CID 139476962) has the molecular formula C11H22FNO and a molecular weight of 203.30 g/mol. Its IUPAC name is (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
PubChem CID139476962
Molecular FormulaC11H22FNO
Molecular Weight203.30 g/mol
Exact Mass203.17
IUPAC Name(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine
SMILESCC(F)OCC1C[C@@H](C)N(C(C)C)C1
InChIInChI=1S/C11H22FNO/c1-8(2)13-6-11(5-9(13)3)7-14-10(4)12/h8-11H,5-7H2,1-4H3/t9-,10?,11?/m1/s1
InChIKeyBEGGSYUHXPWTKG-KPPDAEKUSA-N
XLogP2.44
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.30
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The IUPAC name of (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine (CID 139476962) is (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine.
What is the SMILES notation for (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The canonical SMILES for (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine is CC(F)OCC1C[C@@H](C)N(C(C)C)C1.
What is the InChIKey of (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
The InChIKey is BEGGSYUHXPWTKG-KPPDAEKUSA-N. The full InChI is InChI=1S/C11H22FNO/c1-8(2)13-6-11(5-9(13)3)7-14-10(4)12/h8-11H,5-7H2,1-4H3/t9-,10?,11?/m1/s1.
What are the key properties of (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine?
(2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine has a molecular weight of 203.30 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(1-fluoroethoxymethyl)-2-methyl-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 139476962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).