6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one

C15H18N4O2 — CID 81337520

IUPAC6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one
SMILESCCCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C15H18N4O2/c1-3-6-16-14-11-5-4-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19-13/h4-5,7-8,14,16H,3,6H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyRCTXDYKPTDBURL-UHFFFAOYSA-N
MW286.34 g/mol
LogP2.50
Rot. Bonds5

About 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one

6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one (PubChem CID 81337520) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one
PubChem CID81337520
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one
SMILESCCCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C15H18N4O2/c1-3-6-16-14-11-5-4-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19-13/h4-5,7-8,14,16H,3,6H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyRCTXDYKPTDBURL-UHFFFAOYSA-N
XLogP2.50
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one (CID 81337520) is 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one is CCCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21.
What is the InChIKey of 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one?
The InChIKey is RCTXDYKPTDBURL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-3-6-16-14-11-5-4-10(8-12(11)17-15(14)20)21-13-7-9(2)18-19-13/h4-5,7-8,14,16H,3,6H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one?
6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one has a molecular weight of 286.34 g/mol, XLogP of 2.50, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-(propylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 81337520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).