[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol

C10H18F2N2O — CID 126557145

IUPAC[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
SMILESOC[C@H]1CC(F)(F)CN1C1CCNCC1
InChIInChI=1S/C10H18F2N2O/c11-10(12)5-9(6-15)14(7-10)8-1-3-13-4-2-8/h8-9,13,15H,1-7H2/t9-/m1/s1
InChIKeyPQDDYMGDTKOVRF-SECBINFHSA-N
MW220.26 g/mol
LogP0.44
Rot. Bonds2

About [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol

[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol (PubChem CID 126557145) has the molecular formula C10H18F2N2O and a molecular weight of 220.26 g/mol. Its IUPAC name is [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
PubChem CID126557145
Molecular FormulaC10H18F2N2O
Molecular Weight220.26 g/mol
Exact Mass220.14
IUPAC Name[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol
SMILESOC[C@H]1CC(F)(F)CN1C1CCNCC1
InChIInChI=1S/C10H18F2N2O/c11-10(12)5-9(6-15)14(7-10)8-1-3-13-4-2-8/h8-9,13,15H,1-7H2/t9-/m1/s1
InChIKeyPQDDYMGDTKOVRF-SECBINFHSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(2,2,2-Trifluoroethyl)piperazin-2-yl]propan-1-ol
CID 69976541
[(2R)-4,4-difluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methanol
CID 118303271
[(2R,4S)-4-fluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methanol
CID 118303277
1-[(2R)-4,4-difluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]ethanol
CID 118303296
1-[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]ethanol
CID 118303404
(4,4-Difluoro-1-(piperidin-4-yl)pyrrolidin-2-yl)methanol
CID 121204083
4-(4,4-Difluoro-2-(methoxymethyl)pyrrolidin-1-yl)piperidine
CID 121204116
[4,4-Difluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methanol
CID 123354092
[4-Fluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methanol
CID 123863252
1-(4,4-Difluoro-1-piperidin-4-ylpyrrolidin-2-yl)ethanol
CID 124000499
4-[(2R)-4,4-difluoro-2-(methoxymethyl)pyrrolidin-1-yl]piperidine
CID 124192518
[(2R,4R)-4-fluoro-1-(1-methylpiperidin-4-yl)pyrrolidin-2-yl]methanol
CID 124192524

Frequently Asked Questions

What is the IUPAC name of [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol (CID 126557145) is [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol is OC[C@H]1CC(F)(F)CN1C1CCNCC1.
What is the InChIKey of [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol?
The InChIKey is PQDDYMGDTKOVRF-SECBINFHSA-N. The full InChI is InChI=1S/C10H18F2N2O/c11-10(12)5-9(6-15)14(7-10)8-1-3-13-4-2-8/h8-9,13,15H,1-7H2/t9-/m1/s1.
What are the key properties of [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol?
[(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol has a molecular weight of 220.26 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4,4-difluoro-1-piperidin-4-ylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 126557145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).