3-(9,9-dimethylfluoren-2-yl)azetidine

C18H19N — CID 154791424

IUPAC3-(9,9-dimethylfluoren-2-yl)azetidine
SMILESCC1(C)c2ccccc2-c2ccc(C3CNC3)cc21
InChIInChI=1S/C18H19N/c1-18(2)16-6-4-3-5-14(16)15-8-7-12(9-17(15)18)13-10-19-11-13/h3-9,13,19H,10-11H2,1-2H3
InChIKeyYQWXELRCMMBNFU-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.68
Rot. Bonds1

About 3-(9,9-dimethylfluoren-2-yl)azetidine

3-(9,9-dimethylfluoren-2-yl)azetidine (PubChem CID 154791424) has the molecular formula C18H19N and a molecular weight of 249.36 g/mol. Its IUPAC name is 3-(9,9-dimethylfluoren-2-yl)azetidine.

Molecular Properties

Compound Name3-(9,9-dimethylfluoren-2-yl)azetidine
PubChem CID154791424
Molecular FormulaC18H19N
Molecular Weight249.36 g/mol
Exact Mass249.15
IUPAC Name3-(9,9-dimethylfluoren-2-yl)azetidine
SMILESCC1(C)c2ccccc2-c2ccc(C3CNC3)cc21
InChIInChI=1S/C18H19N/c1-18(2)16-6-4-3-5-14(16)15-8-7-12(9-17(15)18)13-10-19-11-13/h3-9,13,19H,10-11H2,1-2H3
InChIKeyYQWXELRCMMBNFU-UHFFFAOYSA-N
XLogP3.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9,9-dimethyl-2-(4-methylcyclohexyl)fluorene
CID 157150008
2-[(1S,4Z)-6-iodo-3-methylcyclodec-4-en-1-yl]-9,9-dimethylfluorene
CID 89170512
9,9-dimethylfluoren-2-amine;sulfane
CID 142283327
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
3-(9,9-dimethylfluoren-2-yl)prop-2-enoic acid
CID 169461084
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
2-(1-adamantyl)-9,9-dimethylfluorene
CID 59217277
17-(9,9-dimethylfluoren-2-yl)-2-oxaheptacyclo[16.12.0.03,16.04,9.010,15.019,24.025,30]triaconta-1(18),3(16),4,6,8,10,12,14,19,21,23,25,27,29-tetradecaene
CID 146578633
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434

Frequently Asked Questions

What is the IUPAC name of 3-(9,9-dimethylfluoren-2-yl)azetidine?
The IUPAC name of 3-(9,9-dimethylfluoren-2-yl)azetidine (CID 154791424) is 3-(9,9-dimethylfluoren-2-yl)azetidine.
What is the SMILES notation for 3-(9,9-dimethylfluoren-2-yl)azetidine?
The canonical SMILES for 3-(9,9-dimethylfluoren-2-yl)azetidine is CC1(C)c2ccccc2-c2ccc(C3CNC3)cc21.
What is the InChIKey of 3-(9,9-dimethylfluoren-2-yl)azetidine?
The InChIKey is YQWXELRCMMBNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N/c1-18(2)16-6-4-3-5-14(16)15-8-7-12(9-17(15)18)13-10-19-11-13/h3-9,13,19H,10-11H2,1-2H3.
What are the key properties of 3-(9,9-dimethylfluoren-2-yl)azetidine?
3-(9,9-dimethylfluoren-2-yl)azetidine has a molecular weight of 249.36 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9,9-dimethylfluoren-2-yl)azetidine is sourced from PubChem (CID 154791424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).