8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol

C10H18FNO — CID 130626379

IUPAC8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCC1(O)CC2CCC(C1)N2CCF
InChIInChI=1S/C10H18FNO/c1-10(13)6-8-2-3-9(7-10)12(8)5-4-11/h8-9,13H,2-7H2,1H3
InChIKeyDZVYQFHSRIMBMP-UHFFFAOYSA-N
MW187.26 g/mol
LogP1.33
Rot. Bonds2

About 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol

8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 130626379) has the molecular formula C10H18FNO and a molecular weight of 187.26 g/mol. Its IUPAC name is 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID130626379
Molecular FormulaC10H18FNO
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCC1(O)CC2CCC(C1)N2CCF
InChIInChI=1S/C10H18FNO/c1-10(13)6-8-2-3-9(7-10)12(8)5-4-11/h8-9,13H,2-7H2,1H3
InChIKeyDZVYQFHSRIMBMP-UHFFFAOYSA-N
XLogP1.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,8-Dimethyl-8-azabicyclo[3.2.1]octan-3-ol
CID 382572
(1R,5S)-3-hydroxy-8-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octane-3-carbonitrile
CID 10944366
3-Cyano-3-hydroxy-8-(2,2,2-trifluoroethyl)-8-azabicyclo[3.2.1]octane
CID 18316935
3-Cyano-3-hydroxy-8-(2,2-difluoroethyl)-8-azabicyclo[3.2.1]octane
CID 18352160
3-(1,1-Difluoroethyl)-8-methanidyl-8-azoniabicyclo[3.2.1]octan-3-ol
CID 58123630
8-Methyl-3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 61644733
8-[(2-Methylpropan-2-yl)oxymethyl]-3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 146374927
4-(4-Fluoropentyl)-1-methylpiperidin-4-ol
CID 146582970
1-[(1S,2R,3R,5R)-2-fluoro-3-methyl-8-azabicyclo[3.2.1]octan-8-yl]-2-methylpropan-2-ol
CID 178006137
3-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-3-carbonitrile
CID 535477
3-(1,1-Difluoroethyl)-8-methanidyl-8-azabicyclo[3.2.1]octan-3-ol
CID 58123631
3-(3,3,3-Trifluoropropyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 64566988

Frequently Asked Questions

What is the IUPAC name of 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol (CID 130626379) is 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol is CC1(O)CC2CCC(C1)N2CCF.
What is the InChIKey of 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is DZVYQFHSRIMBMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO/c1-10(13)6-8-2-3-9(7-10)12(8)5-4-11/h8-9,13H,2-7H2,1H3.
What are the key properties of 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol?
8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 187.26 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-fluoroethyl)-3-methyl-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 130626379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).