2-(1-fluoropropyl)azetidine

C6H12FN — CID 105427112

IUPAC2-(1-fluoropropyl)azetidine
SMILESCCC(F)C1CCN1
InChIInChI=1S/C6H12FN/c1-2-5(7)6-3-4-8-6/h5-6,8H,2-4H2,1H3
InChIKeyFLGRVBGNAIFIJO-UHFFFAOYSA-N
MW117.17 g/mol
LogP1.10
Rot. Bonds2

About 2-(1-fluoropropyl)azetidine

2-(1-fluoropropyl)azetidine (PubChem CID 105427112) has the molecular formula C6H12FN and a molecular weight of 117.17 g/mol. Its IUPAC name is 2-(1-fluoropropyl)azetidine.

Molecular Properties

Compound Name2-(1-fluoropropyl)azetidine
PubChem CID105427112
Molecular FormulaC6H12FN
Molecular Weight117.17 g/mol
Exact Mass117.10
IUPAC Name2-(1-fluoropropyl)azetidine
SMILESCCC(F)C1CCN1
InChIInChI=1S/C6H12FN/c1-2-5(7)6-3-4-8-6/h5-6,8H,2-4H2,1H3
InChIKeyFLGRVBGNAIFIJO-UHFFFAOYSA-N
XLogP1.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.17
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-[(1S)-1-fluoropropyl]piperidine
CID 124563053
2-(1-fluorobutyl)piperidine
CID 105431346
4-[(1S)-1-fluoropropyl]piperidine
CID 124547570
[(1S)-1-fluoropropyl]cyclopropane
CID 158184537
2-(1-fluoro-3-methylbutyl)piperidine
CID 105435680
2-(1-fluoro-4-methylpentyl)piperidine
CID 106634845
2-(1-fluoro-2-propan-2-yloxyethyl)pyrrolidine
CID 106640244
(2S)-2-pentan-3-ylpiperidine
CID 7048107
(2S)-2-[(2S)-butan-2-yl]pyrrolidine
CID 7047855
2-pentan-3-ylpiperidine
CID 4527381
1-fluoropropylcyclohexane
CID 175482470
2-butan-2-yl-4-ethylpiperidine
CID 79444187

Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoropropyl)azetidine?
The IUPAC name of 2-(1-fluoropropyl)azetidine (CID 105427112) is 2-(1-fluoropropyl)azetidine.
What is the SMILES notation for 2-(1-fluoropropyl)azetidine?
The canonical SMILES for 2-(1-fluoropropyl)azetidine is CCC(F)C1CCN1.
What is the InChIKey of 2-(1-fluoropropyl)azetidine?
The InChIKey is FLGRVBGNAIFIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN/c1-2-5(7)6-3-4-8-6/h5-6,8H,2-4H2,1H3.
What are the key properties of 2-(1-fluoropropyl)azetidine?
2-(1-fluoropropyl)azetidine has a molecular weight of 117.17 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoropropyl)azetidine is sourced from PubChem (CID 105427112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).