3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine

C10H19F2NO — CID 137419190

IUPAC3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine
SMILESCC(C)(C)CN1CC(COC(F)F)C1
InChIInChI=1S/C10H19F2NO/c1-10(2,3)7-13-4-8(5-13)6-14-9(11)12/h8-9H,4-7H2,1-3H3
InChIKeyGAFXSRRQDYNQMU-UHFFFAOYSA-N
MW207.26 g/mol
LogP2.20
Rot. Bonds4

About 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine

3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine (PubChem CID 137419190) has the molecular formula C10H19F2NO and a molecular weight of 207.26 g/mol. Its IUPAC name is 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine.

Molecular Properties

Compound Name3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine
PubChem CID137419190
Molecular FormulaC10H19F2NO
Molecular Weight207.26 g/mol
Exact Mass207.14
IUPAC Name3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine
SMILESCC(C)(C)CN1CC(COC(F)F)C1
InChIInChI=1S/C10H19F2NO/c1-10(2,3)7-13-4-8(5-13)6-14-9(11)12/h8-9H,4-7H2,1-3H3
InChIKeyGAFXSRRQDYNQMU-UHFFFAOYSA-N
XLogP2.20
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(difluoromethoxy)-N,2-dimethyl-N-propan-2-ylpropan-1-amine
CID 129108301
3,3-Difluoro-1-(3-propan-2-yloxypropyl)azetidine
CID 130262376
3,3-Difluoro-1-(3-methoxypropyl)azetidine
CID 130270319
3-(difluoromethoxy)-N-ethyl-N,2-dimethylpropan-1-amine
CID 134269872
N-butyl-3-(difluoromethoxy)-N,2-dimethylpropan-1-amine
CID 134270019
3,3-Difluoro-1-[3-[(2-methylpropan-2-yl)oxy]propyl]azetidine
CID 138607645
3-(3-Fluoropropoxymethyl)-1-(2-methylpropyl)azetidine
CID 142616577
1-Propan-2-yl-3-(trifluoromethoxymethyl)azetidine
CID 148117761
Ethane;6-(1,1,1-trifluoropropan-2-yl)-2-oxa-6-azaspiro[3.3]heptane
CID 153536076
1-Methyl-3-(trifluoromethoxymethyl)azetidine
CID 153582787
1-Ethyl-3-(trifluoromethoxymethyl)azetidine
CID 153582837
3-Fluoro-3-(methoxymethyl)-1-propan-2-ylazetidine
CID 165149910

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine?
The IUPAC name of 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine (CID 137419190) is 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine.
What is the SMILES notation for 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine?
The canonical SMILES for 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine is CC(C)(C)CN1CC(COC(F)F)C1.
What is the InChIKey of 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine?
The InChIKey is GAFXSRRQDYNQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2NO/c1-10(2,3)7-13-4-8(5-13)6-14-9(11)12/h8-9H,4-7H2,1-3H3.
What are the key properties of 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine?
3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine has a molecular weight of 207.26 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxymethyl)-1-(2,2-dimethylpropyl)azetidine is sourced from PubChem (CID 137419190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).