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

C13H14N4O2 — CID 81341673

IUPAC3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
SMILESCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C13H14N4O2/c1-7-5-11(17-16-7)19-8-3-4-9-10(6-8)15-13(18)12(9)14-2/h3-6,12,14H,1-2H3,(H,15,18)(H,16,17)
InChIKeyXTHBTHIBHKDDOC-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.72
Rot. Bonds3

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

3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one (PubChem CID 81341673) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
PubChem CID81341673
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one
SMILESCNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21
InChIInChI=1S/C13H14N4O2/c1-7-5-11(17-16-7)19-8-3-4-9-10(6-8)15-13(18)12(9)14-2/h3-6,12,14H,1-2H3,(H,15,18)(H,16,17)
InChIKeyXTHBTHIBHKDDOC-UHFFFAOYSA-N
XLogP1.72
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

N-(3-methoxyphenyl)-1H-indazole-3-carboxamide
CID 16866354
2-ethyl-5-methyl-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrazole-3-carboxamide
CID 22978081
(3Z)-3-[[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]methylidene]-1H-indol-2-one
CID 136961553
(3Z)-6-methoxy-3-(1H-pyrazol-5-ylmethylidene)-1H-indol-2-one
CID 177373781
1,5-dimethyl-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrazole-3-carboxamide
CID 60111659
5-methyl-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-1H-pyrazole-3-carboxamide
CID 134133286
2-(cyclohexen-1-yl)-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]acetamide
CID 134134764
4-oxo-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]-4-pyrrolidin-1-ylbutanamide
CID 134136223
1-methyl-5-oxo-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrrolidine-3-carboxamide
CID 134136537
2,5-dimethyl-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrazole-3-carboxamide
CID 134136658
(2R)-1-acetyl-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]pyrrolidine-2-carboxamide
CID 134139352
2-oxo-N-[3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]phenyl]imidazolidine-4-carboxamide
CID 134144114

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The IUPAC name of 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one (CID 81341673) is 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The canonical SMILES for 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one is CNC1C(=O)Nc2cc(Oc3cc(C)[nH]n3)ccc21.
What is the InChIKey of 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
The InChIKey is XTHBTHIBHKDDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-7-5-11(17-16-7)19-8-3-4-9-10(6-8)15-13(18)12(9)14-2/h3-6,12,14H,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one?
3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one has a molecular weight of 258.28 g/mol, XLogP of 1.72, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3-dihydroindol-2-one is sourced from PubChem (CID 81341673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).