6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one

C15H18N4O2 — CID 81334026

IUPAC6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Oc3cc(C)nn3C)ccc21
InChIInChI=1S/C15H18N4O2/c1-4-16-14-11-6-5-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19(13)3/h5-8,14,16H,4H2,1-3H3,(H,17,20)
InChIKeyHXJAAXHOBLOPLT-UHFFFAOYSA-N
MW286.34 g/mol
LogP2.12
Rot. Bonds4

About 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one

6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one (PubChem CID 81334026) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one
PubChem CID81334026
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Oc3cc(C)nn3C)ccc21
InChIInChI=1S/C15H18N4O2/c1-4-16-14-11-6-5-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19(13)3/h5-8,14,16H,4H2,1-3H3,(H,17,20)
InChIKeyHXJAAXHOBLOPLT-UHFFFAOYSA-N
XLogP2.12
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one (CID 81334026) is 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one is CCNC1C(=O)Nc2cc(Oc3cc(C)nn3C)ccc21.
What is the InChIKey of 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one?
The InChIKey is HXJAAXHOBLOPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-4-16-14-11-6-5-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19(13)3/h5-8,14,16H,4H2,1-3H3,(H,17,20).
What are the key properties of 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one?
6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one has a molecular weight of 286.34 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylpyrazol-3-yl)oxy-3-(ethylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 81334026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).