3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione

C15H17N3O3 — CID 177160916

IUPAC3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione
SMILESCCc1cc2c(cc1O)c(C1CCC(=O)NC1=O)nn2C
InChIInChI=1S/C15H17N3O3/c1-3-8-6-11-10(7-12(8)19)14(17-18(11)2)9-4-5-13(20)16-15(9)21/h6-7,9,19H,3-5H2,1-2H3,(H,16,20,21)
InChIKeyUALGZBMPGVFCSR-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.36
Rot. Bonds2

About 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione

3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione (PubChem CID 177160916) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione.

Molecular Properties

Compound Name3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione
PubChem CID177160916
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione
SMILESCCc1cc2c(cc1O)c(C1CCC(=O)NC1=O)nn2C
InChIInChI=1S/C15H17N3O3/c1-3-8-6-11-10(7-12(8)19)14(17-18(11)2)9-4-5-13(20)16-15(9)21/h6-7,9,19H,3-5H2,1-2H3,(H,16,20,21)
InChIKeyUALGZBMPGVFCSR-UHFFFAOYSA-N
XLogP1.36
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(1-methyl-6-propanoylindazol-3-yl)piperidine-2,6-dione
CID 167239159
3-(1,5-dimethyl-6-propan-2-ylindazol-3-yl)piperidine-2,6-dione
CID 178017694
3-(6-ethynyl-5-fluoro-1-methylindazol-3-yl)piperidine-2,6-dione
CID 176508925
3-[5-(aminomethyl)-1-methylindazol-3-yl]piperidine-2,6-dione
CID 138460739
1-[3-(2,6-dioxopiperidin-3-yl)-5-fluoro-1-methylindazol-6-yl]piperidine-4-carbaldehyde
CID 177144627
3-[5-fluoro-1-methyl-6-(1-propan-2-ylpiperidin-4-yl)indazol-3-yl]piperidine-2,6-dione
CID 170931692
2-[3-[3-(2,6-dioxopiperidin-3-yl)-1-methylindazol-6-yl]azetidin-1-yl]acetic acid
CID 166168890
tert-butyl 4-[3-(2,6-dioxopiperidin-3-yl)-5-fluoro-1-methylindazol-6-yl]piperazine-1-carboxylate
CID 170322178
3-(1-methyl-6-piperidin-4-ylindazol-3-yl)piperidine-2,6-dione;hydrochloride
CID 170907583
2-[1-[3-[(3R)-2,6-dioxopiperidin-3-yl]-1-methylindazol-6-yl]piperidin-4-yl]acetic acid
CID 156507226
3-[1-methyl-6-[(3R)-pyrrolidin-3-yl]indazol-3-yl]piperidine-2,6-dione
CID 170321612
3-[1-methyl-6-[(3R)-piperidin-3-yl]indazol-3-yl]piperidine-2,6-dione
CID 170321838

Frequently Asked Questions

What is the IUPAC name of 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione?
The IUPAC name of 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione (CID 177160916) is 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione.
What is the SMILES notation for 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione?
The canonical SMILES for 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione is CCc1cc2c(cc1O)c(C1CCC(=O)NC1=O)nn2C.
What is the InChIKey of 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione?
The InChIKey is UALGZBMPGVFCSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-3-8-6-11-10(7-12(8)19)14(17-18(11)2)9-4-5-13(20)16-15(9)21/h6-7,9,19H,3-5H2,1-2H3,(H,16,20,21).
What are the key properties of 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione?
3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione has a molecular weight of 287.32 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-ethyl-5-hydroxy-1-methylindazol-3-yl)piperidine-2,6-dione is sourced from PubChem (CID 177160916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).