3-(1-cyclopentyl-1-fluoroethyl)azetidine

C10H18FN — CID 105434891

IUPAC3-(1-cyclopentyl-1-fluoroethyl)azetidine
SMILESCC(F)(C1CCCC1)C1CNC1
InChIInChI=1S/C10H18FN/c1-10(11,9-6-12-7-9)8-4-2-3-5-8/h8-9,12H,2-7H2,1H3
InChIKeyWFRSGCNDUHYUCF-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.12
Rot. Bonds2

About 3-(1-cyclopentyl-1-fluoroethyl)azetidine

3-(1-cyclopentyl-1-fluoroethyl)azetidine (PubChem CID 105434891) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 3-(1-cyclopentyl-1-fluoroethyl)azetidine.

Molecular Properties

Compound Name3-(1-cyclopentyl-1-fluoroethyl)azetidine
PubChem CID105434891
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name3-(1-cyclopentyl-1-fluoroethyl)azetidine
SMILESCC(F)(C1CCCC1)C1CNC1
InChIInChI=1S/C10H18FN/c1-10(11,9-6-12-7-9)8-4-2-3-5-8/h8-9,12H,2-7H2,1H3
InChIKeyWFRSGCNDUHYUCF-UHFFFAOYSA-N
XLogP2.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopentyl-1-fluoroethyl)azetidine?
The IUPAC name of 3-(1-cyclopentyl-1-fluoroethyl)azetidine (CID 105434891) is 3-(1-cyclopentyl-1-fluoroethyl)azetidine.
What is the SMILES notation for 3-(1-cyclopentyl-1-fluoroethyl)azetidine?
The canonical SMILES for 3-(1-cyclopentyl-1-fluoroethyl)azetidine is CC(F)(C1CCCC1)C1CNC1.
What is the InChIKey of 3-(1-cyclopentyl-1-fluoroethyl)azetidine?
The InChIKey is WFRSGCNDUHYUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN/c1-10(11,9-6-12-7-9)8-4-2-3-5-8/h8-9,12H,2-7H2,1H3.
What are the key properties of 3-(1-cyclopentyl-1-fluoroethyl)azetidine?
3-(1-cyclopentyl-1-fluoroethyl)azetidine has a molecular weight of 171.26 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopentyl-1-fluoroethyl)azetidine is sourced from PubChem (CID 105434891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).