2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole

C18H15FN4OS — CID 162433078

IUPAC2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole
SMILESCn1cc2cc(-c3cc4cn(C5=CCOCC5)nc4s3)cc(F)c2n1
InChIInChI=1S/C18H15FN4OS/c1-22-9-12-6-11(7-15(19)17(12)20-22)16-8-13-10-23(21-18(13)25-16)14-2-4-24-5-3-14/h2,6-10H,3-5H2,1H3
InChIKeyKXWSTZYPYILYLN-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.05
Rot. Bonds2

About 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole

2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole (PubChem CID 162433078) has the molecular formula C18H15FN4OS and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole.

Molecular Properties

Compound Name2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole
PubChem CID162433078
Molecular FormulaC18H15FN4OS
Molecular Weight354.41 g/mol
Exact Mass354.10
IUPAC Name2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole
SMILESCn1cc2cc(-c3cc4cn(C5=CCOCC5)nc4s3)cc(F)c2n1
InChIInChI=1S/C18H15FN4OS/c1-22-9-12-6-11(7-15(19)17(12)20-22)16-8-13-10-23(21-18(13)25-16)14-2-4-24-5-3-14/h2,6-10H,3-5H2,1H3
InChIKeyKXWSTZYPYILYLN-UHFFFAOYSA-N
XLogP4.05
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole 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-(7-fluoro-2-methylindazol-5-yl)-2-[(3S)-pyrrolidin-3-yl]thieno[2,3-c]pyrazole;hydrochloride
CID 169221314
2-cyclohexyl-5-(7-fluoro-2-methylindazol-5-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazole
CID 175623672
7-fluoro-5-(1H-imidazol-2-yl)-2-methylindazole
CID 175904167
cyclohexane;7-fluoro-5-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-methylindazole;methane
CID 170593484
ethane;7-fluoro-2,5-dimethylindazole;2,5,7-trimethylindazole
CID 156888629
tert-butyl 4-[2-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-d][1,3]thiazol-5-yl]-2-methylpiperazine-1-carboxylate
CID 162433031
6-(7-fluoro-2-methylindazol-5-yl)-N-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-[1,3]thiazolo[4,5-b]pyrazin-2-amine
CID 150126397
6-(7-fluoro-2-methylindazol-5-yl)-2-piperidin-4-yloxy-[1,3]thiazolo[4,5-c]pyridine;hydrochloride
CID 153383156
7-fluoro-2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole
CID 139022780
(2E)-2-ethylidene-5-(7-fluoro-2-methylindazol-5-yl)thiophen-3-imine
CID 168979376
8-fluoro-2-methylimidazo[1,2-a]pyridin-6-amine;7-fluoro-2-methylindazol-5-amine
CID 156888280
2-chloro-6-(2,7-dimethylindazol-5-yl)-8-fluoroquinoline
CID 142492191

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole?
The IUPAC name of 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole (CID 162433078) is 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole.
What is the SMILES notation for 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole?
The canonical SMILES for 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole is Cn1cc2cc(-c3cc4cn(C5=CCOCC5)nc4s3)cc(F)c2n1.
What is the InChIKey of 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole?
The InChIKey is KXWSTZYPYILYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN4OS/c1-22-9-12-6-11(7-15(19)17(12)20-22)16-8-13-10-23(21-18(13)25-16)14-2-4-24-5-3-14/h2,6-10H,3-5H2,1H3.
What are the key properties of 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole?
2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole has a molecular weight of 354.41 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dihydro-2H-pyran-4-yl)-5-(7-fluoro-2-methylindazol-5-yl)thieno[2,3-c]pyrazole is sourced from PubChem (CID 162433078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).