3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile

C17H10FN3O — CID 118342588

IUPAC3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile
SMILESCn1c2cc(F)ccc2c(=O)c2c3ccc(C#N)cc3[nH]c21
InChIInChI=1S/C17H10FN3O/c1-21-14-7-10(18)3-5-12(14)16(22)15-11-4-2-9(8-19)6-13(11)20-17(15)21/h2-7,20H,1H3
InChIKeyFJIQKMAWSBCABY-UHFFFAOYSA-N
MW291.29 g/mol
LogP3.18
Rot. Bonds

About 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile

3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile (PubChem CID 118342588) has the molecular formula C17H10FN3O and a molecular weight of 291.29 g/mol. Its IUPAC name is 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile.

Molecular Properties

Compound Name3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile
PubChem CID118342588
Molecular FormulaC17H10FN3O
Molecular Weight291.29 g/mol
Exact Mass291.08
IUPAC Name3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile
SMILESCn1c2cc(F)ccc2c(=O)c2c3ccc(C#N)cc3[nH]c21
InChIInChI=1S/C17H10FN3O/c1-21-14-7-10(18)3-5-12(14)16(22)15-11-4-2-9(8-19)6-13(11)20-17(15)21/h2-7,20H,1H3
InChIKeyFJIQKMAWSBCABY-UHFFFAOYSA-N
XLogP3.18
TPSA61.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.29
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methylpiperazin-1-yl)-11-oxo-5-propan-2-yl-2-propyl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342529
3-(4-methylpiperazin-1-yl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342418
4-fluoro-3-(4-methylpiperazin-1-yl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342602
3-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342603
3-(4-methylpiperazin-1-yl)-11-oxo-2,5-di(propan-2-yl)-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342613
2-ethyl-3-(4-methylpiperazin-1-yl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342621
2,4-difluoro-3-(4-methylpiperazin-1-yl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342650
3-(4-methylpiperazin-1-yl)-2-(2-methylpropyl)-11-oxo-5-propan-2-yl-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118347646
5,5-dimethyl-11-oxo-3-(4-piperidin-1-ylpiperidin-1-yl)-6H-pyrido[4,3-b]carbazole-8-carbonitrile
CID 66835043
5-methyl-3-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile
CID 118342567
5,6-Dihydro-11H-quinindolin-11-one
CID 12205645
1-[3-(11H-indolo[3,2-c]quinolin-6-ylamino)phenyl]ethanone
CID 404609

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile?
The IUPAC name of 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile (CID 118342588) is 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile.
What is the SMILES notation for 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile?
The canonical SMILES for 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile is Cn1c2cc(F)ccc2c(=O)c2c3ccc(C#N)cc3[nH]c21.
What is the InChIKey of 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile?
The InChIKey is FJIQKMAWSBCABY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10FN3O/c1-21-14-7-10(18)3-5-12(14)16(22)15-11-4-2-9(8-19)6-13(11)20-17(15)21/h2-7,20H,1H3.
What are the key properties of 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile?
3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile has a molecular weight of 291.29 g/mol, XLogP of 3.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-methyl-11-oxo-6H-indolo[2,3-b]quinoline-8-carbonitrile is sourced from PubChem (CID 118342588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).