9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

C22H23NO — CID 171939300

IUPAC9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1ccc3c(c1)Cc1ccccc1-3)C2
InChIInChI=1S/C22H23NO/c1-23-18-7-8-19(23)13-17(12-18)22(24)15-6-9-21-16(11-15)10-14-4-2-3-5-20(14)21/h2-6,9,11,17-19H,7-8,10,12-13H2,1H3
InChIKeyWZGYGFRSTCQAJQ-UHFFFAOYSA-N
MW317.43 g/mol
LogP4.31
Rot. Bonds2

About 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone

9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (PubChem CID 171939300) has the molecular formula C22H23NO and a molecular weight of 317.43 g/mol. Its IUPAC name is 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.

Molecular Properties

Compound Name9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
PubChem CID171939300
Molecular FormulaC22H23NO
Molecular Weight317.43 g/mol
Exact Mass317.18
IUPAC Name9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
SMILESCN1C2CCC1CC(C(=O)c1ccc3c(c1)Cc1ccccc1-3)C2
InChIInChI=1S/C22H23NO/c1-23-18-7-8-19(23)13-17(12-18)22(24)15-6-9-21-16(11-15)10-14-4-2-3-5-20(14)21/h2-6,9,11,17-19H,7-8,10,12-13H2,1H3
InChIKeyWZGYGFRSTCQAJQ-UHFFFAOYSA-N
XLogP4.31
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

benzyl 3-(9H-fluorene-2-carbonyl)-9-azabicyclo[3.3.1]nonane-9-carboxylate
CID 171939314
cyclobutyl(9H-fluoren-3-yl)methanone
CID 43337992
2-fluoro-5-(8-methyl-8-azabicyclo[3.2.1]octane-3-carbonyl)benzonitrile
CID 171946784
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(2-phenylphenyl)methanone
CID 171943246
9H-fluoren-3-yl-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]methanone
CID 25103336
[(3S)-1-[1-(9H-fluorene-2-carbonyl)azetidin-3-yl]pyrrolidin-3-yl]-phenylmethanone
CID 67513120
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-[3-methyl-4-(trifluoromethyl)phenyl]methanone
CID 171949885
(2-chlorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
CID 112680607
9H-fluorene-2-carboxamide;hydrochloride
CID 21224790
[3-(9H-fluorene-2-carbonyl)phenyl]-(9H-fluoren-2-yl)methanone
CID 10552019
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(3,4,5-trifluorophenyl)methanone
CID 171948261
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-(4-propan-2-yloxyphenyl)methanone
CID 115997723

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The IUPAC name of 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone (CID 171939300) is 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone.
What is the SMILES notation for 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The canonical SMILES for 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is CN1C2CCC1CC(C(=O)c1ccc3c(c1)Cc1ccccc1-3)C2.
What is the InChIKey of 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
The InChIKey is WZGYGFRSTCQAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO/c1-23-18-7-8-19(23)13-17(12-18)22(24)15-6-9-21-16(11-15)10-14-4-2-3-5-20(14)21/h2-6,9,11,17-19H,7-8,10,12-13H2,1H3.
What are the key properties of 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone?
9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone has a molecular weight of 317.43 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-2-yl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone is sourced from PubChem (CID 171939300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).