1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol

C19H21NO2 — CID 67186252

IUPAC1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol
SMILESOCC1CN(CC2c3ccccc3-c3ccccc32)CC1O
InChIInChI=1S/C19H21NO2/c21-12-13-9-20(11-19(13)22)10-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18-19,21-22H,9-12H2
InChIKeyCMTAFITVBOFRNA-UHFFFAOYSA-N
MW295.38 g/mol
LogP2.08
Rot. Bonds3

About 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol

1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol (PubChem CID 67186252) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol
PubChem CID67186252
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol
SMILESOCC1CN(CC2c3ccccc3-c3ccccc32)CC1O
InChIInChI=1S/C19H21NO2/c21-12-13-9-20(11-19(13)22)10-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18-19,21-22H,9-12H2
InChIKeyCMTAFITVBOFRNA-UHFFFAOYSA-N
XLogP2.08
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol with MolForge

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Related Compounds

2-[{[(3R*,4R*)-1-(biphenyl-2-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-yl]methyl}(methyl)amino]ethanol
CID 70763083
1-{[(3R*,4R*)-1-(2,3-dihydro-1H-inden-2-yl)-4-(hydroxymethyl)pyrrolidin-3-yl]methyl}piperidin-4-ol
CID 72856059
US12528773, Example 190
CID 164048787
1-[(4,7-difluoro-2,3-dihydro-1H-inden-2-yl)methyl]piperidine-3,4,5-triol
CID 157039053
(3R)-1-[(1R,2R)-7-fluoro-1-methyl-2,3-dihydro-1H-inden-2-yl]pyrrolidin-3-ol
CID 164603258
(3R)-1-[(1R,2R)-7-fluoro-1-propan-2-yl-2,3-dihydro-1H-inden-2-yl]pyrrolidin-3-ol
CID 171443189
US12528773, Example 62
CID 166834254
(3R)-1-(2,3-dihydro-1H-inden-2-yl)pyrrolidin-3-ol
CID 129504492
(2s,4r)-trans-4-Hydroxy-2-(1,1-diphenylmethyl)-pyrrolidinylmethanol
CID 129675403
9H-fluoren-9-yl-[(3R,4R)-3-fluoro-4-hydroxypyrrolidin-1-yl]methanone
CID 131895931
1-(2,2-Diphenylethyl)pyrrolidine-3,4-diol
CID 13822825
4-(Hydroxymethyl)-1-(2-phenylethyl)pyrrolidin-3-ol
CID 18520474

Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol?
The IUPAC name of 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol (CID 67186252) is 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol?
The canonical SMILES for 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol is OCC1CN(CC2c3ccccc3-c3ccccc32)CC1O.
What is the InChIKey of 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol?
The InChIKey is CMTAFITVBOFRNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c21-12-13-9-20(11-19(13)22)10-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18-19,21-22H,9-12H2.
What are the key properties of 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol?
1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol has a molecular weight of 295.38 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-9-ylmethyl)-4-(hydroxymethyl)pyrrolidin-3-ol is sourced from PubChem (CID 67186252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).