7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane

C15H20FNO — CID 114872207

IUPAC7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane
SMILESCC1NCC2(CCCC2)OC1c1cccc(F)c1
InChIInChI=1S/C15H20FNO/c1-11-14(12-5-4-6-13(16)9-12)18-15(10-17-11)7-2-3-8-15/h4-6,9,11,14,17H,2-3,7-8,10H2,1H3
InChIKeyCYWUQKGFITZPKH-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.19
Rot. Bonds1

About 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane

7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane (PubChem CID 114872207) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane.

Molecular Properties

Compound Name7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane
PubChem CID114872207
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane
SMILESCC1NCC2(CCCC2)OC1c1cccc(F)c1
InChIInChI=1S/C15H20FNO/c1-11-14(12-5-4-6-13(16)9-12)18-15(10-17-11)7-2-3-8-15/h4-6,9,11,14,17H,2-3,7-8,10H2,1H3
InChIKeyCYWUQKGFITZPKH-UHFFFAOYSA-N
XLogP3.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-methyl-7-phenyl-6-oxa-9-azaspiro[4.5]decane
CID 65103492
2-(2-fluorophenyl)-3-methyl-1-oxa-4-azaspiro[5.6]dodecane
CID 115996216
2-(5-fluoro-2-pyridinyl)-3-methyl-1-oxa-4-azaspiro[5.6]dodecane
CID 115940635
2-(3-fluorophenyl)-3,6-dimethylmorpholine
CID 114872193
2-(3-fluorophenyl)-3,6-dimethyl-1,4-oxazepane
CID 114872204
2-(3-fluorophenyl)-3-methyl-6-propan-2-ylmorpholine
CID 114872237
6-ethyl-2-(3-fluorophenyl)-3-methylmorpholine
CID 114872236
(4R)-3,3-difluoro-2-(3-fluorophenyl)-4-methylpyrrolidine
CID 66684519
5-(3-fluorophenyl)-11-methyl-3-azaspiro[5.5]undecane
CID 79433045
2-(3-fluorophenyl)-3-methylpyrrolidine
CID 3582862
2-(3-fluorophenyl)-4-methyl-1,3-oxazolidine
CID 82280855
(1R,5S)-2,4-bis(3-fluorophenyl)-1,5-dimethyl-3-azabicyclo[3.3.1]nonan-9-one
CID 10618184

Frequently Asked Questions

What is the IUPAC name of 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane?
The IUPAC name of 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane (CID 114872207) is 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane.
What is the SMILES notation for 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane?
The canonical SMILES for 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane is CC1NCC2(CCCC2)OC1c1cccc(F)c1.
What is the InChIKey of 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane?
The InChIKey is CYWUQKGFITZPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11-14(12-5-4-6-13(16)9-12)18-15(10-17-11)7-2-3-8-15/h4-6,9,11,14,17H,2-3,7-8,10H2,1H3.
What are the key properties of 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane?
7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane has a molecular weight of 249.33 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-fluorophenyl)-8-methyl-6-oxa-9-azaspiro[4.5]decane is sourced from PubChem (CID 114872207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).