9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline

C19H18FN — CID 15458737

IUPAC9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline
SMILESCC1=CC(C)(C)Nc2cc3c(cc21)-c1cccc(F)c1C3
InChIInChI=1S/C19H18FN/c1-11-10-19(2,3)21-18-8-12-7-16-13(5-4-6-17(16)20)15(12)9-14(11)18/h4-6,8-10,21H,7H2,1-3H3
InChIKeyHABVEGMNVSOGOR-UHFFFAOYSA-N
MW279.36 g/mol
LogP5.00
Rot. Bonds

About 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline

9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline (PubChem CID 15458737) has the molecular formula C19H18FN and a molecular weight of 279.36 g/mol. Its IUPAC name is 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline.

Molecular Properties

Compound Name9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline
PubChem CID15458737
Molecular FormulaC19H18FN
Molecular Weight279.36 g/mol
Exact Mass279.14
IUPAC Name9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline
SMILESCC1=CC(C)(C)Nc2cc3c(cc21)-c1cccc(F)c1C3
InChIInChI=1S/C19H18FN/c1-11-10-19(2,3)21-18-8-12-7-16-13(5-4-6-17(16)20)15(12)9-14(11)18/h4-6,8-10,21H,7H2,1-3H3
InChIKeyHABVEGMNVSOGOR-UHFFFAOYSA-N
XLogP5.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.36
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline?
The IUPAC name of 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline (CID 15458737) is 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline.
What is the SMILES notation for 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline?
The canonical SMILES for 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline is CC1=CC(C)(C)Nc2cc3c(cc21)-c1cccc(F)c1C3.
What is the InChIKey of 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline?
The InChIKey is HABVEGMNVSOGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN/c1-11-10-19(2,3)21-18-8-12-7-16-13(5-4-6-17(16)20)15(12)9-14(11)18/h4-6,8-10,21H,7H2,1-3H3.
What are the key properties of 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline?
9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline has a molecular weight of 279.36 g/mol, XLogP of 5.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluoro-2,2,4-trimethyl-1,10-dihydroindeno[1,2-g]quinoline is sourced from PubChem (CID 15458737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).