5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione

C16H19FN2O2 — CID 103496641

IUPAC5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione
SMILESCC(C)C1CCN(c2cc3c(cc2F)C(=O)C(=O)N3)CC1
InChIInChI=1S/C16H19FN2O2/c1-9(2)10-3-5-19(6-4-10)14-8-13-11(7-12(14)17)15(20)16(21)18-13/h7-10H,3-6H2,1-2H3,(H,18,20,21)
InChIKeyXPFVODNQZGBBGX-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.83
Rot. Bonds2

About 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione

5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione (PubChem CID 103496641) has the molecular formula C16H19FN2O2 and a molecular weight of 290.34 g/mol. Its IUPAC name is 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione.

Molecular Properties

Compound Name5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione
PubChem CID103496641
Molecular FormulaC16H19FN2O2
Molecular Weight290.34 g/mol
Exact Mass290.14
IUPAC Name5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione
SMILESCC(C)C1CCN(c2cc3c(cc2F)C(=O)C(=O)N3)CC1
InChIInChI=1S/C16H19FN2O2/c1-9(2)10-3-5-19(6-4-10)14-8-13-11(7-12(14)17)15(20)16(21)18-13/h7-10H,3-6H2,1-2H3,(H,18,20,21)
InChIKeyXPFVODNQZGBBGX-UHFFFAOYSA-N
XLogP2.83
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-fluoro-6-(4-propan-2-ylpiperazin-1-yl)-1H-indole-2,3-dione
CID 80729747
5-fluoro-6-(4-methylazepan-1-yl)-1H-indole-2,3-dione
CID 80747278
6-(4-ethylpiperazin-1-yl)-5-fluoro-1H-indole-2,3-dione
CID 80747271
5-bromo-6-[4-(1-hydroxyethyl)piperidin-1-yl]-1H-indole-2,3-dione
CID 106836223
5-fluoro-6-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-1H-indole-2,3-dione
CID 114410247
5-fluoro-6-(3-methylthiomorpholin-4-yl)-1H-indole-2,3-dione
CID 80758039
5-fluoro-3-hydroxy-6-[4-(1-hydroxyethyl)piperidin-1-yl]-1,3-dihydroindol-2-one
CID 106836471
5-bromo-6-(4-ethylazepan-1-yl)-1H-indole-2,3-dione
CID 79343459
6-[cyclopentyl(methyl)amino]-5-fluoro-1H-indole-2,3-dione
CID 80746568
5-chloro-6-(2-propan-2-ylpyrrolidin-1-yl)-1H-indole-2,3-dione
CID 79336233
2-amino-4-fluoro-5-(4-propan-2-ylpiperidin-1-yl)benzamide
CID 103501374
5-chloro-6-(4,4-dimethylazepan-1-yl)-1H-indole-2,3-dione
CID 79342974

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione?
The IUPAC name of 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione (CID 103496641) is 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione.
What is the SMILES notation for 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione?
The canonical SMILES for 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione is CC(C)C1CCN(c2cc3c(cc2F)C(=O)C(=O)N3)CC1.
What is the InChIKey of 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione?
The InChIKey is XPFVODNQZGBBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O2/c1-9(2)10-3-5-19(6-4-10)14-8-13-11(7-12(14)17)15(20)16(21)18-13/h7-10H,3-6H2,1-2H3,(H,18,20,21).
What are the key properties of 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione?
5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione has a molecular weight of 290.34 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-(4-propan-2-ylpiperidin-1-yl)-1H-indole-2,3-dione is sourced from PubChem (CID 103496641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).