1-(1-adamantyl)-9H-fluorene

C23H24 — CID 141137518

IUPAC1-(1-adamantyl)-9H-fluorene
SMILESc1ccc2c(c1)Cc1c-2cccc1C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C23H24/c1-2-5-19-18(4-1)11-21-20(19)6-3-7-22(21)23-12-15-8-16(13-23)10-17(9-15)14-23/h1-7,15-17H,8-14H2
InChIKeyYMQPROZOYQCVCH-UHFFFAOYSA-N
MW300.44 g/mol
LogP5.73
Rot. Bonds1

About 1-(1-adamantyl)-9H-fluorene

1-(1-adamantyl)-9H-fluorene (PubChem CID 141137518) has the molecular formula C23H24 and a molecular weight of 300.44 g/mol. Its IUPAC name is 1-(1-adamantyl)-9H-fluorene.

Molecular Properties

Compound Name1-(1-adamantyl)-9H-fluorene
PubChem CID141137518
Molecular FormulaC23H24
Molecular Weight300.44 g/mol
Exact Mass300.19
IUPAC Name1-(1-adamantyl)-9H-fluorene
SMILESc1ccc2c(c1)Cc1c-2cccc1C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C23H24/c1-2-5-19-18(4-1)11-21-20(19)6-3-7-22(21)23-12-15-8-16(13-23)10-17(9-15)14-23/h1-7,15-17H,8-14H2
InChIKeyYMQPROZOYQCVCH-UHFFFAOYSA-N
XLogP5.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.44
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(1-adamantyl)-6-amino-4-(9H-fluoren-1-yl)phenol
CID 152525649
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-(2-naphthalen-2-yl-2-adamantyl)-9H-fluorene
CID 163601006
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
CID 123562270
CID 123562270
bis(9H-fluoren-1-yl)-dimethylgermane
CID 22068853
4-(1-adamantyl)-2-benzofuran-1,3-dione
CID 141365559
4-(9H-fluoren-1-yl)benzene-1,2,3-triol
CID 139434157
Fluorenylsilane
CID 22104606
4-[2-(9H-fluoren-4-yl)-2-adamantyl]-9H-fluorene
CID 163498832
3-(9H-fluoren-1-yl)benzene-1,2-diamine
CID 66643080
1-(2-phenoxyphenyl)adamantane
CID 54125777

Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantyl)-9H-fluorene?
The IUPAC name of 1-(1-adamantyl)-9H-fluorene (CID 141137518) is 1-(1-adamantyl)-9H-fluorene.
What is the SMILES notation for 1-(1-adamantyl)-9H-fluorene?
The canonical SMILES for 1-(1-adamantyl)-9H-fluorene is c1ccc2c(c1)Cc1c-2cccc1C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-(1-adamantyl)-9H-fluorene?
The InChIKey is YMQPROZOYQCVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24/c1-2-5-19-18(4-1)11-21-20(19)6-3-7-22(21)23-12-15-8-16(13-23)10-17(9-15)14-23/h1-7,15-17H,8-14H2.
What are the key properties of 1-(1-adamantyl)-9H-fluorene?
1-(1-adamantyl)-9H-fluorene has a molecular weight of 300.44 g/mol, XLogP of 5.73, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantyl)-9H-fluorene is sourced from PubChem (CID 141137518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).