[(2R)-3,4-difluoropyrrolidin-2-yl]methanol

C5H9F2NO — CID 175590240

IUPAC[(2R)-3,4-difluoropyrrolidin-2-yl]methanol
SMILESOC[C@H]1NCC(F)C1F
InChIInChI=1S/C5H9F2NO/c6-3-1-8-4(2-9)5(3)7/h3-5,8-9H,1-2H2/t3?,4-,5?/m1/s1
InChIKeyUQZNLEKGKBCMLK-ACHVEOLNSA-N
MW137.13 g/mol
LogP-0.37
Rot. Bonds1

About [(2R)-3,4-difluoropyrrolidin-2-yl]methanol

[(2R)-3,4-difluoropyrrolidin-2-yl]methanol (PubChem CID 175590240) has the molecular formula C5H9F2NO and a molecular weight of 137.13 g/mol. Its IUPAC name is [(2R)-3,4-difluoropyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-3,4-difluoropyrrolidin-2-yl]methanol
PubChem CID175590240
Molecular FormulaC5H9F2NO
Molecular Weight137.13 g/mol
Exact Mass137.07
IUPAC Name[(2R)-3,4-difluoropyrrolidin-2-yl]methanol
SMILESOC[C@H]1NCC(F)C1F
InChIInChI=1S/C5H9F2NO/c6-3-1-8-4(2-9)5(3)7/h3-5,8-9H,1-2H2/t3?,4-,5?/m1/s1
InChIKeyUQZNLEKGKBCMLK-ACHVEOLNSA-N
XLogP-0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.13
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-3,4-difluoropyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-3,4-difluoropyrrolidin-2-yl]methanol (CID 175590240) is [(2R)-3,4-difluoropyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-3,4-difluoropyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-3,4-difluoropyrrolidin-2-yl]methanol is OC[C@H]1NCC(F)C1F.
What is the InChIKey of [(2R)-3,4-difluoropyrrolidin-2-yl]methanol?
The InChIKey is UQZNLEKGKBCMLK-ACHVEOLNSA-N. The full InChI is InChI=1S/C5H9F2NO/c6-3-1-8-4(2-9)5(3)7/h3-5,8-9H,1-2H2/t3?,4-,5?/m1/s1.
What are the key properties of [(2R)-3,4-difluoropyrrolidin-2-yl]methanol?
[(2R)-3,4-difluoropyrrolidin-2-yl]methanol has a molecular weight of 137.13 g/mol, XLogP of -0.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-3,4-difluoropyrrolidin-2-yl]methanol is sourced from PubChem (CID 175590240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).