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

C14H16N4O2 — CID 81341479

IUPAC3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C14H16N4O2/c1-3-15-13-10-5-4-9(7-11(10)16-14(13)19)20-12-6-8(2)17-18-12/h4-7,13,15H,3H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyUXIIUKHHHBTFDE-UHFFFAOYSA-N
MW272.31 g/mol
LogP2.11
Rot. Bonds4

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

3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one (PubChem CID 81341479) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
PubChem CID81341479
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C14H16N4O2/c1-3-15-13-10-5-4-9(7-11(10)16-14(13)19)20-12-6-8(2)17-18-12/h4-7,13,15H,3H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyUXIIUKHHHBTFDE-UHFFFAOYSA-N
XLogP2.11
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The IUPAC name of 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one (CID 81341479) is 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The canonical SMILES for 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one is CCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21.
What is the InChIKey of 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The InChIKey is UXIIUKHHHBTFDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-3-15-13-10-5-4-9(7-11(10)16-14(13)19)20-12-6-8(2)17-18-12/h4-7,13,15H,3H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one has a molecular weight of 272.31 g/mol, XLogP of 2.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one is sourced from PubChem (CID 81341479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).