(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol

C10H16F3NO — CID 98113046

IUPAC(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol
SMILESOC1(C(F)(F)F)[C@@H]2CCCC[C@@H]1CNC2
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)7-3-1-2-4-8(9)6-14-5-7/h7-8,14-15H,1-6H2/t7-,8-/m1/s1
InChIKeySNGDXPDTHZGOQP-HTQZYQBOSA-N
MW223.24 g/mol
LogP1.69
Rot. Bonds

About (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol

(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol (PubChem CID 98113046) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol.

Molecular Properties

Compound Name(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol
PubChem CID98113046
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol
SMILESOC1(C(F)(F)F)[C@@H]2CCCC[C@@H]1CNC2
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)7-3-1-2-4-8(9)6-14-5-7/h7-8,14-15H,1-6H2/t7-,8-/m1/s1
InChIKeySNGDXPDTHZGOQP-HTQZYQBOSA-N
XLogP1.69
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3aS,6aS)-3a-(trifluoromethyl)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 163409847
1,2,3,4,5,6,7,7a-octahydroisoindol-3a-ol
CID 70541295
(3S,5R)-4-cyclohexyl-3,5-dimethylpiperidin-4-ol
CID 59130993
5-cyclohexyl-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 115026607
1,2,3,4,5,6,7,7a-octahydroisoindole-3a,4-diol
CID 141422735
5-(trifluoromethyl)-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 50990621
7a-methyl-2-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-1H-inden-2-ol
CID 59331059
3-[cyclopentyl(difluoro)methyl]azetidine
CID 105436127
1-(azetidin-3-yl)cyclohexan-1-ol
CID 130510137
1-piperidin-3-ylcyclopropan-1-ol;hydrochloride
CID 127264219
3-[1-(trifluoromethyl)cyclopropyl]pyrrolidine
CID 83906289
1-cycloheptyl-4-(trifluoromethyl)cyclohexan-1-ol
CID 82927882

Frequently Asked Questions

What is the IUPAC name of (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol?
The IUPAC name of (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol (CID 98113046) is (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol.
What is the SMILES notation for (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol?
The canonical SMILES for (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol is OC1(C(F)(F)F)[C@@H]2CCCC[C@@H]1CNC2.
What is the InChIKey of (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol?
The InChIKey is SNGDXPDTHZGOQP-HTQZYQBOSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)9(15)7-3-1-2-4-8(9)6-14-5-7/h7-8,14-15H,1-6H2/t7-,8-/m1/s1.
What are the key properties of (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol?
(1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol has a molecular weight of 223.24 g/mol, XLogP of 1.69, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,6R)-10-(trifluoromethyl)-8-azabicyclo[4.3.1]decan-10-ol is sourced from PubChem (CID 98113046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).