(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine

C9H18FNO — CID 129108293

IUPAC(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine
SMILESCC(F)OCC1C[C@@H](C)N(C)C1
InChIInChI=1S/C9H18FNO/c1-7-4-9(5-11(7)3)6-12-8(2)10/h7-9H,4-6H2,1-3H3/t7-,8?,9?/m1/s1
InChIKeyDMFXMKVETHKAJQ-AFPNSQJFSA-N
MW175.25 g/mol
LogP1.66
Rot. Bonds3

About (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine

(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine (PubChem CID 129108293) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine.

Molecular Properties

Compound Name(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine
PubChem CID129108293
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine
SMILESCC(F)OCC1C[C@@H](C)N(C)C1
InChIInChI=1S/C9H18FNO/c1-7-4-9(5-11(7)3)6-12-8(2)10/h7-9H,4-6H2,1-3H3/t7-,8?,9?/m1/s1
InChIKeyDMFXMKVETHKAJQ-AFPNSQJFSA-N
XLogP1.66
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.66
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)-1,2-dimethylpyrrolidine?
The IUPAC name of (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine (CID 129108293) is (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine.
What is the SMILES notation for (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine?
The canonical SMILES for (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine is CC(F)OCC1C[C@@H](C)N(C)C1.
What is the InChIKey of (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine?
The InChIKey is DMFXMKVETHKAJQ-AFPNSQJFSA-N. The full InChI is InChI=1S/C9H18FNO/c1-7-4-9(5-11(7)3)6-12-8(2)10/h7-9H,4-6H2,1-3H3/t7-,8?,9?/m1/s1.
What are the key properties of (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine?
(2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine has a molecular weight of 175.25 g/mol, XLogP of 1.66, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(1-fluoroethoxymethyl)-1,2-dimethylpyrrolidine is sourced from PubChem (CID 129108293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).