(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol

C11H13F2NO — CID 148871488

IUPAC(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
SMILESO[C@H](c1cccc(F)c1F)[C@@H]1CCCN1
InChIInChI=1S/C11H13F2NO/c12-8-4-1-3-7(10(8)13)11(15)9-5-2-6-14-9/h1,3-4,9,11,14-15H,2,5-6H2/t9-,11+/m0/s1
InChIKeyPBGODAZCVAQXNN-GXSJLCMTSA-N
MW213.23 g/mol
LogP1.75
Rot. Bonds2

About (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol

(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol (PubChem CID 148871488) has the molecular formula C11H13F2NO and a molecular weight of 213.23 g/mol. Its IUPAC name is (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
PubChem CID148871488
Molecular FormulaC11H13F2NO
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
SMILESO[C@H](c1cccc(F)c1F)[C@@H]1CCCN1
InChIInChI=1S/C11H13F2NO/c12-8-4-1-3-7(10(8)13)11(15)9-5-2-6-14-9/h1,3-4,9,11,14-15H,2,5-6H2/t9-,11+/m0/s1
InChIKeyPBGODAZCVAQXNN-GXSJLCMTSA-N
XLogP1.75
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopentyl-(2,3-difluorophenyl)methanol
CID 63894572
pyrrolidin-2-yl-(2,4,5-trifluorophenyl)methanol
CID 103303135
(2-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654197
2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 134282165
(R)-(2,3,4,5,6-pentafluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 155010567
2-[azepan-2-yl(hydroxy)methyl]phenol
CID 84686926
ethane;(2,3,4,5,6-pentafluorophenyl)-pyrrolidin-2-ylmethanol
CID 142507550
3-chloro-4-[hydroxy(piperidin-2-yl)methyl]phenol;(2-fluorophenyl)-piperidin-2-ylmethanol
CID 158994486
(R)-(3,4-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 93183518
(2-chlorophenyl)-pyrrolidin-2-ylmethanol;propane
CID 142544047
(2-amino-3-pyridinyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654106
(2-amino-3-pyridinyl)-pyrrolidin-2-ylmethanol
CID 106639861

Frequently Asked Questions

What is the IUPAC name of (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol?
The IUPAC name of (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol (CID 148871488) is (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol.
What is the SMILES notation for (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol?
The canonical SMILES for (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol is O[C@H](c1cccc(F)c1F)[C@@H]1CCCN1.
What is the InChIKey of (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol?
The InChIKey is PBGODAZCVAQXNN-GXSJLCMTSA-N. The full InChI is InChI=1S/C11H13F2NO/c12-8-4-1-3-7(10(8)13)11(15)9-5-2-6-14-9/h1,3-4,9,11,14-15H,2,5-6H2/t9-,11+/m0/s1.
What are the key properties of (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol?
(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol has a molecular weight of 213.23 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol is sourced from PubChem (CID 148871488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).