[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol

C6H11F2NO — CID 125117369

IUPAC[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol
SMILESC[C@]1(CO)CC(F)(F)CN1
InChIInChI=1S/C6H11F2NO/c1-5(4-10)2-6(7,8)3-9-5/h9-10H,2-4H2,1H3/t5-/m1/s1
InChIKeyZRYXDNDJJKCPSS-RXMQYKEDSA-N
MW151.16 g/mol
LogP0.37
Rot. Bonds1

About [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol

[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol (PubChem CID 125117369) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol
PubChem CID125117369
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol
SMILESC[C@]1(CO)CC(F)(F)CN1
InChIInChI=1S/C6H11F2NO/c1-5(4-10)2-6(7,8)3-9-5/h9-10H,2-4H2,1H3/t5-/m1/s1
InChIKeyZRYXDNDJJKCPSS-RXMQYKEDSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol (CID 125117369) is [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol is C[C@]1(CO)CC(F)(F)CN1.
What is the InChIKey of [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol?
The InChIKey is ZRYXDNDJJKCPSS-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-5(4-10)2-6(7,8)3-9-5/h9-10H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of [(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol?
[(2R)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol has a molecular weight of 151.16 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)-4,4-difluoro-2-methylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 125117369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).