8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane

C11H20FN — CID 176784628

IUPAC8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane
SMILESCC(C)C1(F)CNCC2(CCC2)C1
InChIInChI=1S/C11H20FN/c1-9(2)11(12)6-10(4-3-5-10)7-13-8-11/h9,13H,3-8H2,1-2H3
InChIKeyPBGAYVSWLWUXKG-UHFFFAOYSA-N
MW185.29 g/mol
LogP2.51
Rot. Bonds1

About 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane

8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane (PubChem CID 176784628) has the molecular formula C11H20FN and a molecular weight of 185.29 g/mol. Its IUPAC name is 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane.

Molecular Properties

Compound Name8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane
PubChem CID176784628
Molecular FormulaC11H20FN
Molecular Weight185.29 g/mol
Exact Mass185.16
IUPAC Name8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane
SMILESCC(C)C1(F)CNCC2(CCC2)C1
InChIInChI=1S/C11H20FN/c1-9(2)11(12)6-10(4-3-5-10)7-13-8-11/h9,13H,3-8H2,1-2H3
InChIKeyPBGAYVSWLWUXKG-UHFFFAOYSA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Cyclobutylpiperidine
CID 54092508
3-(Cyclobutylmethyl)piperidine
CID 83671184
9-Methyl-6-azaspiro(3.5)nonane
CID 71757949
5-Methyl-2-azaspiro[5.5]undecane
CID 75420881
9-(Trifluoromethyl)-6-azaspiro[3.5]nonane
CID 112756500
(3S)-4-(3,3-dimethylbutyl)-3-fluoropiperidine
CID 58286767
(3R)-4-(2,2-dimethylpropyl)-3-fluoropiperidine
CID 58286790
(3R)-4-(3,3-dimethylbutyl)-3-fluoropiperidine
CID 58286803
4-Tert-butyl-3-fluoropiperidine
CID 58286853
3-(2,2-Dimethylpropyl)-3-fluoropiperidine
CID 68055526
4-Fluoro-4-pentylpiperidine
CID 69214285
4-(2,2-Dimethylpropyl)-3-fluoropiperidine
CID 76741484

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane?
The IUPAC name of 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane (CID 176784628) is 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane.
What is the SMILES notation for 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane?
The canonical SMILES for 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane is CC(C)C1(F)CNCC2(CCC2)C1.
What is the InChIKey of 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane?
The InChIKey is PBGAYVSWLWUXKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FN/c1-9(2)11(12)6-10(4-3-5-10)7-13-8-11/h9,13H,3-8H2,1-2H3.
What are the key properties of 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane?
8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane has a molecular weight of 185.29 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-8-propan-2-yl-6-azaspiro[3.5]nonane is sourced from PubChem (CID 176784628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).