ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile

C19H17FN2 — CID 144713889

IUPACethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile
SMILESCC.CC1(C)c2ccccc2-c2cc(C#N)c(F)c(C#N)c21
InChIInChI=1S/C17H11FN2.C2H6/c1-17(2)14-6-4-3-5-11(14)12-7-10(8-19)16(18)13(9-20)15(12)17;1-2/h3-7H,1-2H3;1-2H3
InChIKeyHEVYBNNJUVXNDS-UHFFFAOYSA-N
MW292.36 g/mol
LogP4.90
Rot. Bonds

About ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile

ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile (PubChem CID 144713889) has the molecular formula C19H17FN2 and a molecular weight of 292.36 g/mol. Its IUPAC name is ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile.

Molecular Properties

Compound Nameethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile
PubChem CID144713889
Molecular FormulaC19H17FN2
Molecular Weight292.36 g/mol
Exact Mass292.14
IUPAC Nameethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile
SMILESCC.CC1(C)c2ccccc2-c2cc(C#N)c(F)c(C#N)c21
InChIInChI=1S/C17H11FN2.C2H6/c1-17(2)14-6-4-3-5-11(14)12-7-10(8-19)16(18)13(9-20)15(12)17;1-2/h3-7H,1-2H3;1-2H3
InChIKeyHEVYBNNJUVXNDS-UHFFFAOYSA-N
XLogP4.90
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9,9-dimethylfluorene-4-carbonitrile
CID 67375715
4-(20,20-dimethyl-8-pentacyclo[11.7.1.02,7.09,21.014,19]henicosa-1(21),2,4,6,8,10,12,14,16,18-decaenyl)naphthalene-1-carbonitrile
CID 118965152
2-carbazol-9-yl-5-[2,5-dicyano-4-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]benzene-1,4-dicarbonitrile
CID 129290887
1-(3-fluoro-5-methylphenyl)-9,9-dimethylfluorene
CID 90266577
2-carbazol-9-yl-5-[4-(9,9-dimethylfluoren-1-yl)-6-phenyl-1,3,5-triazin-2-yl]-4-fluorobenzonitrile
CID 139549800
3,5-bis(12,12-dimethylindeno[1,2-c]carbazol-5-yl)benzene-1,2-dicarbonitrile
CID 166572260
3-fluoro-9,9-dimethylfluorene
CID 130217991
2-[9-(9,9-dimethylfluoren-3-yl)carbazol-4-yl]benzene-1,3-dicarbonitrile
CID 155357389
2-[9-(9,9-dimethylfluoren-2-yl)carbazol-1-yl]benzene-1,3-dicarbonitrile
CID 155357432
ethane;9-fluoro-9-methylfluorene
CID 163249751
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
2-carbazol-9-yl-5-(11,11,19,19-tetramethyl-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5,7,9,13,16,18(26),20,22,24-dodecaen-15-yl)benzene-1,4-dicarbonitrile
CID 121328841

Frequently Asked Questions

What is the IUPAC name of ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile?
The IUPAC name of ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile (CID 144713889) is ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile.
What is the SMILES notation for ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile?
The canonical SMILES for ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile is CC.CC1(C)c2ccccc2-c2cc(C#N)c(F)c(C#N)c21.
What is the InChIKey of ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile?
The InChIKey is HEVYBNNJUVXNDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2.C2H6/c1-17(2)14-6-4-3-5-11(14)12-7-10(8-19)16(18)13(9-20)15(12)17;1-2/h3-7H,1-2H3;1-2H3.
What are the key properties of ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile?
ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile has a molecular weight of 292.36 g/mol, XLogP of 4.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-fluoro-9,9-dimethylfluorene-1,3-dicarbonitrile is sourced from PubChem (CID 144713889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).