9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone

C21H21NO2 — CID 25103336

IUPAC9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
SMILESO=C(c1ccc2c(c1)-c1ccccc1C2)N1[C@@H]2CC[C@H]1CC(O)C2
InChIInChI=1S/C21H21NO2/c23-18-11-16-7-8-17(12-18)22(16)21(24)15-6-5-14-9-13-3-1-2-4-19(13)20(14)10-15/h1-6,10,16-18,23H,7-9,11-12H2/t16-,17+,18?
InChIKeyRMBJOGUJSOYQRA-JWTNVVGKSA-N
MW319.40 g/mol
LogP3.39
Rot. Bonds1

About 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone

9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone (PubChem CID 25103336) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone.

Molecular Properties

Compound Name9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
PubChem CID25103336
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
SMILESO=C(c1ccc2c(c1)-c1ccccc1C2)N1[C@@H]2CC[C@H]1CC(O)C2
InChIInChI=1S/C21H21NO2/c23-18-11-16-7-8-17(12-18)22(16)21(24)15-6-5-14-9-13-3-1-2-4-19(13)20(14)10-15/h1-6,10,16-18,23H,7-9,11-12H2/t16-,17+,18?
InChIKeyRMBJOGUJSOYQRA-JWTNVVGKSA-N
XLogP3.39
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone with MolForge

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Related Compounds

cyclobutyl(9H-fluoren-3-yl)methanone
CID 43337992
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-[4-(trifluoromethyl)phenyl]methanone
CID 63763280
3-(3-hydroxy-8-azabicyclo[3.2.1]octane-8-carbonyl)benzenecarbothioamide
CID 63769125
(3-chloro-4-methylphenyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 55241627
(4-bromo-3-methylphenyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 112705964
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 63762528
(3-fluoro-4-nitrophenyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 63762184
9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
CID 171939300
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-[4-(methylamino)phenyl]methanone
CID 55237037
(4-fluoro-3-hydroxyphenyl)-[(1R,5S)-3-hydroxy-9-azabicyclo[3.3.1]nonan-9-yl]methanone
CID 163307294
4-(3-hydroxy-8-azabicyclo[3.2.1]octane-8-carbonyl)-1-methylpyridin-2-one
CID 55243953
(4-fluoro-3-methoxyphenyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 81002135

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The IUPAC name of 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone (CID 25103336) is 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone.
What is the SMILES notation for 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The canonical SMILES for 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone is O=C(c1ccc2c(c1)-c1ccccc1C2)N1[C@@H]2CC[C@H]1CC(O)C2.
What is the InChIKey of 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
The InChIKey is RMBJOGUJSOYQRA-JWTNVVGKSA-N. The full InChI is InChI=1S/C21H21NO2/c23-18-11-16-7-8-17(12-18)22(16)21(24)15-6-5-14-9-13-3-1-2-4-19(13)20(14)10-15/h1-6,10,16-18,23H,7-9,11-12H2/t16-,17+,18?.
What are the key properties of 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone?
9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone has a molecular weight of 319.40 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone is sourced from PubChem (CID 25103336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).