7,9,9-trimethylfluorene-2-carbonitrile

C17H15N — CID 129176208

IUPAC7,9,9-trimethylfluorene-2-carbonitrile
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C#N)ccc1-2
InChIInChI=1S/C17H15N/c1-11-4-6-13-14-7-5-12(10-18)9-16(14)17(2,3)15(13)8-11/h4-9H,1-3H3
InChIKeyNRXCIWYWTBFEJP-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.17
Rot. Bonds

About 7,9,9-trimethylfluorene-2-carbonitrile

7,9,9-trimethylfluorene-2-carbonitrile (PubChem CID 129176208) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 7,9,9-trimethylfluorene-2-carbonitrile.

Molecular Properties

Compound Name7,9,9-trimethylfluorene-2-carbonitrile
PubChem CID129176208
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name7,9,9-trimethylfluorene-2-carbonitrile
SMILESCc1ccc2c(c1)C(C)(C)c1cc(C#N)ccc1-2
InChIInChI=1S/C17H15N/c1-11-4-6-13-14-7-5-12(10-18)9-16(14)17(2,3)15(13)8-11/h4-9H,1-3H3
InChIKeyNRXCIWYWTBFEJP-UHFFFAOYSA-N
XLogP4.17
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,7-dimethyl-9,9'-spirobi[fluorene]-2',7'-dicarbonitrile
CID 118408607
2,7,9,9-tetramethylfluorene
CID 22951928
7-[4-[7-(4-cyanophenyl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluorene-2-carbonitrile
CID 170276569
2,6,9,9-tetramethylfluorene
CID 23527438
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
carbanide;2,7,9,9-tetramethylfluorene;7,9,9-trimethyl-2H-fluoren-2-ide;vanadium(2+)
CID 159557413
5-hydroxy-7,7-dimethylbenzo[g]fluorene-3,9-dicarbonitrile
CID 68530423
2-ethyl-7,9,9-trimethylfluorene
CID 59167125
2,9,9-trimethyl-7-[3-(7,9,9-trimethylfluoren-2-yl)phenyl]fluorene
CID 58943521
1,1,6-trimethyl-2,3-dimethylideneindene
CID 145331674
9,9-dimethyl-7-[4-[6-phenyl-2-(3-phenylphenyl)pyrimidin-4-yl]phenyl]fluorene-2-carbonitrile
CID 162775748
7,9-dimethyl-9H-fluorene-2-carbonitrile
CID 149236608

Frequently Asked Questions

What is the IUPAC name of 7,9,9-trimethylfluorene-2-carbonitrile?
The IUPAC name of 7,9,9-trimethylfluorene-2-carbonitrile (CID 129176208) is 7,9,9-trimethylfluorene-2-carbonitrile.
What is the SMILES notation for 7,9,9-trimethylfluorene-2-carbonitrile?
The canonical SMILES for 7,9,9-trimethylfluorene-2-carbonitrile is Cc1ccc2c(c1)C(C)(C)c1cc(C#N)ccc1-2.
What is the InChIKey of 7,9,9-trimethylfluorene-2-carbonitrile?
The InChIKey is NRXCIWYWTBFEJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-11-4-6-13-14-7-5-12(10-18)9-16(14)17(2,3)15(13)8-11/h4-9H,1-3H3.
What are the key properties of 7,9,9-trimethylfluorene-2-carbonitrile?
7,9,9-trimethylfluorene-2-carbonitrile has a molecular weight of 233.31 g/mol, XLogP of 4.17, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9,9-trimethylfluorene-2-carbonitrile is sourced from PubChem (CID 129176208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).