3,3-difluoro-1-(oxetan-3-yl)azetidine

C6H9F2NO — CID 118992153

IUPAC3,3-difluoro-1-(oxetan-3-yl)azetidine
SMILESFC1(F)CN(C2COC2)C1
InChIInChI=1S/C6H9F2NO/c7-6(8)3-9(4-6)5-1-10-2-5/h5H,1-4H2
InChIKeyWNOQFAPQQWIUBH-UHFFFAOYSA-N
MW149.14 g/mol
LogP0.34
Rot. Bonds1

About 3,3-difluoro-1-(oxetan-3-yl)azetidine

3,3-difluoro-1-(oxetan-3-yl)azetidine (PubChem CID 118992153) has the molecular formula C6H9F2NO and a molecular weight of 149.14 g/mol. Its IUPAC name is 3,3-difluoro-1-(oxetan-3-yl)azetidine.

Molecular Properties

Compound Name3,3-difluoro-1-(oxetan-3-yl)azetidine
PubChem CID118992153
Molecular FormulaC6H9F2NO
Molecular Weight149.14 g/mol
Exact Mass149.07
IUPAC Name3,3-difluoro-1-(oxetan-3-yl)azetidine
SMILESFC1(F)CN(C2COC2)C1
InChIInChI=1S/C6H9F2NO/c7-6(8)3-9(4-6)5-1-10-2-5/h5H,1-4H2
InChIKeyWNOQFAPQQWIUBH-UHFFFAOYSA-N
XLogP0.34
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.14
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-Difluoro-1-(2-methoxyethyl)azetidine
CID 122269382
1-(2,2-Difluoroethyl)-2-(methoxymethyl)azetidine
CID 131229680
1-Propan-2-yl-3-(trifluoromethoxy)azetidine
CID 137409406
3-(Difluoromethoxy)-1-propan-2-ylazetidine
CID 146385462
N-(3,3-difluoropropyl)-N-methyloxetan-3-amine
CID 146481324
3-Fluoro-3-methyl-1-(oxetan-3-yl)azetidine
CID 156518520
3-Fluoro-1-(oxetan-3-yl)azetidine-3-thiol
CID 156518547
(2S)-2-(methoxymethyl)-1-(2,2,2-trifluoroethyl)azetidine
CID 167030997
3-Fluoro-1-(oxetan-3-yl)azetidine
CID 169254454
1-[2-(1,1-Difluoroethoxy)ethyl]azetidine
CID 171795370
2-Methyl-1-[2-(trifluoromethoxy)ethyl]azetidine
CID 171796161
2-(Methoxymethyl)-1-(2,2,2-trifluoroethyl)azetidine
CID 172328532

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-(oxetan-3-yl)azetidine?
The IUPAC name of 3,3-difluoro-1-(oxetan-3-yl)azetidine (CID 118992153) is 3,3-difluoro-1-(oxetan-3-yl)azetidine.
What is the SMILES notation for 3,3-difluoro-1-(oxetan-3-yl)azetidine?
The canonical SMILES for 3,3-difluoro-1-(oxetan-3-yl)azetidine is FC1(F)CN(C2COC2)C1.
What is the InChIKey of 3,3-difluoro-1-(oxetan-3-yl)azetidine?
The InChIKey is WNOQFAPQQWIUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2NO/c7-6(8)3-9(4-6)5-1-10-2-5/h5H,1-4H2.
What are the key properties of 3,3-difluoro-1-(oxetan-3-yl)azetidine?
3,3-difluoro-1-(oxetan-3-yl)azetidine has a molecular weight of 149.14 g/mol, XLogP of 0.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-(oxetan-3-yl)azetidine is sourced from PubChem (CID 118992153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).