[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol

C5H8FNO — CID 169101018

IUPAC[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol
SMILESOC[C@H]1C=C(F)CN1
InChIInChI=1S/C5H8FNO/c6-4-1-5(3-8)7-2-4/h1,5,7-8H,2-3H2/t5-/m1/s1
InChIKeyJJRXNYDOOUNDPG-RXMQYKEDSA-N
MW117.12 g/mol
LogP-0.20
Rot. Bonds1

About [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol

[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol (PubChem CID 169101018) has the molecular formula C5H8FNO and a molecular weight of 117.12 g/mol. Its IUPAC name is [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol
PubChem CID169101018
Molecular FormulaC5H8FNO
Molecular Weight117.12 g/mol
Exact Mass117.06
IUPAC Name[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol
SMILESOC[C@H]1C=C(F)CN1
InChIInChI=1S/C5H8FNO/c6-4-1-5(3-8)7-2-4/h1,5,7-8H,2-3H2/t5-/m1/s1
InChIKeyJJRXNYDOOUNDPG-RXMQYKEDSA-N
XLogP-0.20
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.12
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol?
The IUPAC name of [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol (CID 169101018) is [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol.
What is the SMILES notation for [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol?
The canonical SMILES for [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol is OC[C@H]1C=C(F)CN1.
What is the InChIKey of [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol?
The InChIKey is JJRXNYDOOUNDPG-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H8FNO/c6-4-1-5(3-8)7-2-4/h1,5,7-8H,2-3H2/t5-/m1/s1.
What are the key properties of [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol?
[(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol has a molecular weight of 117.12 g/mol, XLogP of -0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-fluoro-2,5-dihydro-1H-pyrrol-2-yl]methanol is sourced from PubChem (CID 169101018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).