[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol

C8H14FNO — CID 172513105

IUPAC[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol
SMILESOC[C@H]1CCN2C[C@H](F)CC12
InChIInChI=1S/C8H14FNO/c9-7-3-8-6(5-11)1-2-10(8)4-7/h6-8,11H,1-5H2/t6-,7-,8?/m1/s1
InChIKeyDIKNZXPRRNUCNT-GCJDJSOWSA-N
MW159.20 g/mol
LogP0.41
Rot. Bonds1

About [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol

[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol (PubChem CID 172513105) has the molecular formula C8H14FNO and a molecular weight of 159.20 g/mol. Its IUPAC name is [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol.

Molecular Properties

Compound Name[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol
PubChem CID172513105
Molecular FormulaC8H14FNO
Molecular Weight159.20 g/mol
Exact Mass159.11
IUPAC Name[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol
SMILESOC[C@H]1CCN2C[C@H](F)CC12
InChIInChI=1S/C8H14FNO/c9-7-3-8-6(5-11)1-2-10(8)4-7/h6-8,11H,1-5H2/t6-,7-,8?/m1/s1
InChIKeyDIKNZXPRRNUCNT-GCJDJSOWSA-N
XLogP0.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.20
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol with MolForge

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Related Compounds

Isoretronecanol
CID 3080563
(-)-Trachelanthamidine
CID 188288
Lindelofidine
CID 11126361
(hexahydro-1H-pyrrolizin-1-yl)methanol
CID 544380
(+)-Trachelanthamidine
CID 94259
r-Hydroxymethylpyrrolizidine
CID 91746611
(hexahydro-1H-pyrrolizin-1-yl)methanol hydrochloride
CID 155858889
[(1R)-6,6-difluoro-1,2,3,5,7,8-hexahydropyrrolizin-1-yl]methanol
CID 118109121
2-[(8S)-6,6-difluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]ethanol
CID 167178790
[(2S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-2-yl]methanol
CID 170005038
[(1R,2R)-2-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol
CID 171756880
(6R,8R)-6-fluoro-8-methyl-1,2,3,5,6,7-hexahydropyrrolizin-2-ol
CID 172158673

Frequently Asked Questions

What is the IUPAC name of [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol?
The IUPAC name of [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol (CID 172513105) is [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol.
What is the SMILES notation for [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol?
The canonical SMILES for [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol is OC[C@H]1CCN2C[C@H](F)CC12.
What is the InChIKey of [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol?
The InChIKey is DIKNZXPRRNUCNT-GCJDJSOWSA-N. The full InChI is InChI=1S/C8H14FNO/c9-7-3-8-6(5-11)1-2-10(8)4-7/h6-8,11H,1-5H2/t6-,7-,8?/m1/s1.
What are the key properties of [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol?
[(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol has a molecular weight of 159.20 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,6R)-6-fluoro-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methanol is sourced from PubChem (CID 172513105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).