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

C10H16FNO — CID 171614098

IUPAC[(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol
SMILESCC=C1CN2C[C@H](F)C[C@@]2(CO)C1
InChIInChI=1S/C10H16FNO/c1-2-8-3-10(7-13)4-9(11)6-12(10)5-8/h2,9,13H,3-7H2,1H3/t9-,10-/m1/s1
InChIKeyPZEAUWJPGFVUQK-NXEZZACHSA-N
MW185.24 g/mol
LogP1.11
Rot. Bonds1

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

[(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol (PubChem CID 171614098) has the molecular formula C10H16FNO and a molecular weight of 185.24 g/mol. Its IUPAC name is [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol.

Molecular Properties

Compound Name[(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol
PubChem CID171614098
Molecular FormulaC10H16FNO
Molecular Weight185.24 g/mol
Exact Mass185.12
IUPAC Name[(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol
SMILESCC=C1CN2C[C@H](F)C[C@@]2(CO)C1
InChIInChI=1S/C10H16FNO/c1-2-8-3-10(7-13)4-9(11)6-12(10)5-8/h2,9,13H,3-7H2,1H3/t9-,10-/m1/s1
InChIKeyPZEAUWJPGFVUQK-NXEZZACHSA-N
XLogP1.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.24
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol?
The IUPAC name of [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol (CID 171614098) is [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol.
What is the SMILES notation for [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol?
The canonical SMILES for [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol is CC=C1CN2C[C@H](F)C[C@@]2(CO)C1.
What is the InChIKey of [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol?
The InChIKey is PZEAUWJPGFVUQK-NXEZZACHSA-N. The full InChI is InChI=1S/C10H16FNO/c1-2-8-3-10(7-13)4-9(11)6-12(10)5-8/h2,9,13H,3-7H2,1H3/t9-,10-/m1/s1.
What are the key properties of [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol?
[(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol has a molecular weight of 185.24 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,8R)-6-ethylidene-2-fluoro-2,3,5,7-tetrahydro-1H-pyrrolizin-8-yl]methanol is sourced from PubChem (CID 171614098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).