(7R)-7-fluoro-5-oxaspiro[3.5]nonane

C8H13FO — CID 159499413

IUPAC(7R)-7-fluoro-5-oxaspiro[3.5]nonane
SMILESF[C@@H]1CCC2(CCC2)OC1
InChIInChI=1S/C8H13FO/c9-7-2-5-8(10-6-7)3-1-4-8/h7H,1-6H2/t7-/m1/s1
InChIKeyLZERBASQDRNEBH-SSDOTTSWSA-N
MW144.19 g/mol
LogP2.06
Rot. Bonds

About (7R)-7-fluoro-5-oxaspiro[3.5]nonane

(7R)-7-fluoro-5-oxaspiro[3.5]nonane (PubChem CID 159499413) has the molecular formula C8H13FO and a molecular weight of 144.19 g/mol. Its IUPAC name is (7R)-7-fluoro-5-oxaspiro[3.5]nonane.

Molecular Properties

Compound Name(7R)-7-fluoro-5-oxaspiro[3.5]nonane
PubChem CID159499413
Molecular FormulaC8H13FO
Molecular Weight144.19 g/mol
Exact Mass144.10
IUPAC Name(7R)-7-fluoro-5-oxaspiro[3.5]nonane
SMILESF[C@@H]1CCC2(CCC2)OC1
InChIInChI=1S/C8H13FO/c9-7-2-5-8(10-6-7)3-1-4-8/h7H,1-6H2/t7-/m1/s1
InChIKeyLZERBASQDRNEBH-SSDOTTSWSA-N
XLogP2.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-Fluoro-6-oxaspiro[4.5]decane
CID 25208211
4-Fluoro-1-oxaspiro[5.6]dodecane
CID 25208212
4-Fluoro-1-oxaspiro[5.5]undecane
CID 102032176
4-Fluoro-1-oxaspiro[5.11]heptadecane
CID 154713512
5-Oxaspiro[3.5]nonane
CID 68037582
2,2-Bis(4,4-difluorobutyl)oxane
CID 57090603
(2R)-2-(cyclobutylmethyl)-4-fluorooxane
CID 130286327
2-(Cyclobutylmethyl)-4-fluorooxane
CID 130286868
8-(Trifluoromethyl)-5-oxaspiro[3.5]nonane;hydrochloride
CID 158541860
7-(Trifluoromethyl)-5-oxaspiro[3.5]nonane;hydrochloride
CID 160344221
(2S,3S)-2-ethyl-3-fluoro-2,4-dimethyloxane
CID 167250613
4,4-Difluoro-6-oxaspiro[4.5]decane
CID 172170576

Frequently Asked Questions

What is the IUPAC name of (7R)-7-fluoro-5-oxaspiro[3.5]nonane?
The IUPAC name of (7R)-7-fluoro-5-oxaspiro[3.5]nonane (CID 159499413) is (7R)-7-fluoro-5-oxaspiro[3.5]nonane.
What is the SMILES notation for (7R)-7-fluoro-5-oxaspiro[3.5]nonane?
The canonical SMILES for (7R)-7-fluoro-5-oxaspiro[3.5]nonane is F[C@@H]1CCC2(CCC2)OC1.
What is the InChIKey of (7R)-7-fluoro-5-oxaspiro[3.5]nonane?
The InChIKey is LZERBASQDRNEBH-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H13FO/c9-7-2-5-8(10-6-7)3-1-4-8/h7H,1-6H2/t7-/m1/s1.
What are the key properties of (7R)-7-fluoro-5-oxaspiro[3.5]nonane?
(7R)-7-fluoro-5-oxaspiro[3.5]nonane has a molecular weight of 144.19 g/mol, XLogP of 2.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-fluoro-5-oxaspiro[3.5]nonane is sourced from PubChem (CID 159499413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).