3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine

C10H18FNO — CID 112563337

IUPAC3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine
SMILESFC1(CCCC2CCCO2)CNC1
InChIInChI=1S/C10H18FNO/c11-10(7-12-8-10)5-1-3-9-4-2-6-13-9/h9,12H,1-8H2
InChIKeyWRIARJICNHGMSP-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.65
Rot. Bonds4

About 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine

3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine (PubChem CID 112563337) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine.

Molecular Properties

Compound Name3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine
PubChem CID112563337
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine
SMILESFC1(CCCC2CCCO2)CNC1
InChIInChI=1S/C10H18FNO/c11-10(7-12-8-10)5-1-3-9-4-2-6-13-9/h9,12H,1-8H2
InChIKeyWRIARJICNHGMSP-UHFFFAOYSA-N
XLogP1.65
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Fluoro-3-[2-(oxolan-2-yl)ethyl]azetidine
CID 112563547
2-Fluoro-2-methyl-5-(oxolan-2-yl)pentan-1-amine
CID 112565044
3-Fluoro-3-(oxolan-2-ylmethyl)azetidine
CID 122239828
3-Fluoro-3-(oxan-2-ylmethyl)azetidine
CID 122239846
3-fluoro-3-[[(2R)-oxan-2-yl]methyl]azetidine
CID 129531987
3-fluoro-3-[[(2S)-oxan-2-yl]methyl]azetidine
CID 129531988
3-fluoro-3-[[(2R)-oxolan-2-yl]methyl]azetidine
CID 129531989
3-fluoro-3-[[(2S)-oxolan-2-yl]methyl]azetidine
CID 129531990
N,2-dimethyl-5-(oxolan-2-yl)pentan-1-amine
CID 65166070
N,2,2-trimethyl-5-(oxolan-2-yl)pentan-1-amine
CID 65166448
3-Methyl-3-(oxolan-2-ylmethyl)azetidine
CID 79451106
3-(2-Methylpropyl)-3-[3-(oxolan-2-yl)propyl]azetidine
CID 79451112

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine?
The IUPAC name of 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine (CID 112563337) is 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine.
What is the SMILES notation for 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine?
The canonical SMILES for 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine is FC1(CCCC2CCCO2)CNC1.
What is the InChIKey of 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine?
The InChIKey is WRIARJICNHGMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c11-10(7-12-8-10)5-1-3-9-4-2-6-13-9/h9,12H,1-8H2.
What are the key properties of 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine?
3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine has a molecular weight of 187.26 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-[3-(oxolan-2-yl)propyl]azetidine is sourced from PubChem (CID 112563337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).