(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine

C10H20FNO — CID 175612145

IUPAC(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine
SMILESCC(C)O[C@@H](C)[C@H]1N(C)CC1(C)F
InChIInChI=1S/C10H20FNO/c1-7(2)13-8(3)9-10(4,11)6-12(9)5/h7-9H,6H2,1-5H3/t8-,9+,10?/m0/s1
InChIKeyCLGFYWNPIUPZRK-QIIDTADFSA-N
MW189.27 g/mol
LogP1.84
Rot. Bonds3

About (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine

(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine (PubChem CID 175612145) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine.

Molecular Properties

Compound Name(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine
PubChem CID175612145
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine
SMILESCC(C)O[C@@H](C)[C@H]1N(C)CC1(C)F
InChIInChI=1S/C10H20FNO/c1-7(2)13-8(3)9-10(4,11)6-12(9)5/h7-9H,6H2,1-5H3/t8-,9+,10?/m0/s1
InChIKeyCLGFYWNPIUPZRK-QIIDTADFSA-N
XLogP1.84
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4,4-Dimethylpentyl)-3-(1-fluoroethoxy)azetidine
CID 134271509
3-(2-Fluoroethoxy)-1-(2-methylheptan-2-yl)azetidine
CID 155452212
1-(2,2-Difluoroethyl)-2-(propan-2-yloxymethyl)azetidine
CID 167031001
2-(Propan-2-yloxymethyl)-1-(2,2,2-trifluoroethyl)azetidine
CID 167031002
(2R)-3-fluoro-2-[(1S)-1-methoxyethyl]-1-methylazetidine
CID 167254824
(8S)-8-fluoro-2-propan-2-yl-5-oxa-2-azaspiro[3.4]octane
CID 167292236
(8R)-8-fluoro-2-propan-2-yl-5-oxa-2-azaspiro[3.4]octane
CID 167292238
(2S)-1-ethyl-2-[(1S)-1-fluoroethyl]-2-(methoxymethyl)azetidine
CID 169852235
1-(7,7-Dimethyloctan-4-yl)-3-(2-fluoroethoxy)azetidine
CID 170061753
(2R)-3,3-difluoro-1-methyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine
CID 170212214
(2R)-3-fluoro-1-methyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine
CID 170212219
(2R)-3,3-difluoro-1-methyl-2-[(1S)-1-[(2-methylpropan-2-yl)oxy]ethyl]azetidine
CID 171756029

Frequently Asked Questions

What is the IUPAC name of (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine?
The IUPAC name of (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine (CID 175612145) is (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine.
What is the SMILES notation for (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine?
The canonical SMILES for (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine is CC(C)O[C@@H](C)[C@H]1N(C)CC1(C)F.
What is the InChIKey of (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine?
The InChIKey is CLGFYWNPIUPZRK-QIIDTADFSA-N. The full InChI is InChI=1S/C10H20FNO/c1-7(2)13-8(3)9-10(4,11)6-12(9)5/h7-9H,6H2,1-5H3/t8-,9+,10?/m0/s1.
What are the key properties of (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine?
(2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine has a molecular weight of 189.27 g/mol, XLogP of 1.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-fluoro-1,3-dimethyl-2-[(1S)-1-propan-2-yloxyethyl]azetidine is sourced from PubChem (CID 175612145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).