5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one

C13H11N3OS — CID 145258604

IUPAC5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one
SMILESO=c1cc(-n2ncc3cc(C4CC4)ccc32)s[nH]1
InChIInChI=1S/C13H11N3OS/c17-12-6-13(18-15-12)16-11-4-3-9(8-1-2-8)5-10(11)7-14-16/h3-8H,1-2H2,(H,15,17)
InChIKeyJMEFCNGRMUROON-UHFFFAOYSA-N
MW257.32 g/mol
LogP2.65
Rot. Bonds2

About 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one

5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one (PubChem CID 145258604) has the molecular formula C13H11N3OS and a molecular weight of 257.32 g/mol. Its IUPAC name is 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one.

Molecular Properties

Compound Name5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one
PubChem CID145258604
Molecular FormulaC13H11N3OS
Molecular Weight257.32 g/mol
Exact Mass257.06
IUPAC Name5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one
SMILESO=c1cc(-n2ncc3cc(C4CC4)ccc32)s[nH]1
InChIInChI=1S/C13H11N3OS/c17-12-6-13(18-15-12)16-11-4-3-9(8-1-2-8)5-10(11)7-14-16/h3-8H,1-2H2,(H,15,17)
InChIKeyJMEFCNGRMUROON-UHFFFAOYSA-N
XLogP2.65
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one 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

1-bromo-5-cyclopropylindazole
CID 135156225
1-methyl-5-(4-propan-2-ylcyclohexyl)indazole
CID 140629080
1-[4-[1-(4-fluoro-3-hydroxyphenyl)indazol-5-yl]piperidin-1-yl]ethanone
CID 163234431
2-(4-cyclopropylphenyl)phthalazin-1-one
CID 155730870
7-(1-methylindazol-5-yl)-2-azaspiro[3.5]nonane-2-carbaldehyde
CID 169002472
ethane;3-[[4-(1-methylindazol-5-yl)cyclohexyl]oxymethyl]-N-methylsulfanylpiperidin-4-amine
CID 170638624
3-[[4-(1-methylindazol-5-yl)cyclohexyl]oxymethyl]-N-methylsulfanylpiperidin-4-amine
CID 170638488
1-methyl-3-(4-propan-2-ylcyclohexyl)indazole;1-methyl-5-(4-propan-2-ylcyclohexyl)indazole
CID 177327977
5-cyclopropyl-3-iodo-1-methylindazole
CID 118990677
2,2-dimethyl-1-[3-[[4-(1-methylindazol-5-yl)cyclohexyl]oxymethyl]-4-(methylsulfanylamino)piperidin-1-yl]propan-1-one
CID 170638497
6-cyclopropyl-2H-isoquinolin-1-one
CID 90054240
5-(3-fluorophenyl)-1-[1-(4-fluorophenyl)indazol-5-yl]pyrrolidin-2-one
CID 166989402

Frequently Asked Questions

What is the IUPAC name of 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one?
The IUPAC name of 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one (CID 145258604) is 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one.
What is the SMILES notation for 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one?
The canonical SMILES for 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one is O=c1cc(-n2ncc3cc(C4CC4)ccc32)s[nH]1.
What is the InChIKey of 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one?
The InChIKey is JMEFCNGRMUROON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3OS/c17-12-6-13(18-15-12)16-11-4-3-9(8-1-2-8)5-10(11)7-14-16/h3-8H,1-2H2,(H,15,17).
What are the key properties of 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one?
5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one has a molecular weight of 257.32 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-cyclopropylindazol-1-yl)-1,2-thiazol-3-one is sourced from PubChem (CID 145258604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).