4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol

C23H24FN5O — CID 168978633

IUPAC4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol
SMILESC1CCC2(CC2)NC1.Cn1cc2cc(-c3cnc4ccccc4n3)c(O)c(F)c2n1
InChIInChI=1S/C16H11FN4O.C7H13N/c1-21-8-9-6-10(16(22)14(17)15(9)20-21)13-7-18-11-4-2-3-5-12(11)19-13;1-2-6-8-7(3-1)4-5-7/h2-8,22H,1H3;8H,1-6H2
InChIKeyYLBJQLMLASPKBV-UHFFFAOYSA-N
MW405.48 g/mol
LogP4.32
Rot. Bonds1

About 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol

4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol (PubChem CID 168978633) has the molecular formula C23H24FN5O and a molecular weight of 405.48 g/mol. Its IUPAC name is 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol.

Molecular Properties

Compound Name4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol
PubChem CID168978633
Molecular FormulaC23H24FN5O
Molecular Weight405.48 g/mol
Exact Mass405.20
IUPAC Name4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol
SMILESC1CCC2(CC2)NC1.Cn1cc2cc(-c3cnc4ccccc4n3)c(O)c(F)c2n1
InChIInChI=1S/C16H11FN4O.C7H13N/c1-21-8-9-6-10(16(22)14(17)15(9)20-21)13-7-18-11-4-2-3-5-12(11)19-13;1-2-6-8-7(3-1)4-5-7/h2-8,22H,1H3;8H,1-6H2
InChIKeyYLBJQLMLASPKBV-UHFFFAOYSA-N
XLogP4.32
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol with MolForge

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Related Compounds

7-fluoro-5-[6-(3-hydroxypiperidin-4-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 168976923
7-fluoro-5-[6-[(3S,4S)-3-hydroxypiperidin-4-yl]-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 170008953
cyclobutane;7-fluoro-2-methyl-5-(6-pyrrolidin-1-yl-1,5-naphthyridin-2-yl)indazol-6-ol;methanamine
CID 168977767
5-[6-[2-(cyclobutylamino)ethylamino]quinoxalin-2-yl]-2,7-dimethylindazol-6-ol
CID 168978374
5-(4-chloro-6-piperazin-1-yl-1,8-naphthyridin-2-yl)-7-fluoro-2-methylindazol-6-ol
CID 168978332
7-fluoro-2-methyl-5-(2-piperidin-4-ylpyrazolo[4,3-d][1,3]thiazol-5-yl)indazol-6-ol
CID 168979240
5-ethyl-7-fluoro-2-methylindazol-6-ol
CID 168902393
7-fluoro-2-methyl-5-[4-(methylamino)-6-piperazin-1-ylquinazolin-2-yl]indazol-6-ol
CID 177078744
2-(2,4-difluorophenyl)quinoxaline
CID 102428437
5-[6-[(3S)-3-(azetidin-1-yl)pyrrolidin-1-yl]-4-chloro-1,8-naphthyridin-2-yl]-7-fluoro-2-methylindazol-6-ol
CID 168978359
2-(4,4-difluoro-2,5,5-trimethylpyrazolo[3,4-c]pyridin-7-yl)quinoxaline
CID 142383413
1-(2-quinoxalin-2-ylphenyl)ethanone
CID 163871254

Frequently Asked Questions

What is the IUPAC name of 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol?
The IUPAC name of 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol (CID 168978633) is 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol.
What is the SMILES notation for 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol?
The canonical SMILES for 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol is C1CCC2(CC2)NC1.Cn1cc2cc(-c3cnc4ccccc4n3)c(O)c(F)c2n1.
What is the InChIKey of 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol?
The InChIKey is YLBJQLMLASPKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN4O.C7H13N/c1-21-8-9-6-10(16(22)14(17)15(9)20-21)13-7-18-11-4-2-3-5-12(11)19-13;1-2-6-8-7(3-1)4-5-7/h2-8,22H,1H3;8H,1-6H2.
What are the key properties of 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol?
4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol has a molecular weight of 405.48 g/mol, XLogP of 4.32, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-azaspiro[2.5]octane;7-fluoro-2-methyl-5-quinoxalin-2-ylindazol-6-ol is sourced from PubChem (CID 168978633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).