5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one

C18H20N2O — CID 43192468

IUPAC5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one
SMILESCc1ccc2c(c1)C(Nc1ccccc1C(C)C)C(=O)N2
InChIInChI=1S/C18H20N2O/c1-11(2)13-6-4-5-7-15(13)19-17-14-10-12(3)8-9-16(14)20-18(17)21/h4-11,17,19H,1-3H3,(H,20,21)
InChIKeyGLDLWKMHFUGXOC-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.22
Rot. Bonds3

About 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one

5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one (PubChem CID 43192468) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one
PubChem CID43192468
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one
SMILESCc1ccc2c(c1)C(Nc1ccccc1C(C)C)C(=O)N2
InChIInChI=1S/C18H20N2O/c1-11(2)13-6-4-5-7-15(13)19-17-14-10-12(3)8-9-16(14)20-18(17)21/h4-11,17,19H,1-3H3,(H,20,21)
InChIKeyGLDLWKMHFUGXOC-UHFFFAOYSA-N
XLogP4.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-bromoanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43194493
3-[2-(dimethylamino)anilino]-5-methyl-1,3-dihydroindol-2-one
CID 43726504
3-(2,4-dimethylanilino)-1,3-dihydroindol-2-one
CID 43189774
3-(2,6-difluoroanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43123963
3-(2,4-dimethoxyanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43823453
3-(4-tert-butylanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43823625
3-(3,5-dimethoxyanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43824323
3-(1-cyclopropylethylamino)-5-methyl-1,3-dihydroindol-2-one
CID 43533291
3-(4-ethoxyanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43191389
5-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)amino]-1,3-dihydroindol-2-one
CID 43204486
5-methyl-3-(2-phenylethylamino)-1,3-dihydroindol-2-one
CID 43194106
N-[(3S)-5-methyl-2-oxo-1,3-dihydroindol-3-yl]acetamide
CID 9178373

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one?
The IUPAC name of 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one (CID 43192468) is 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one is Cc1ccc2c(c1)C(Nc1ccccc1C(C)C)C(=O)N2.
What is the InChIKey of 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one?
The InChIKey is GLDLWKMHFUGXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-11(2)13-6-4-5-7-15(13)19-17-14-10-12(3)8-9-16(14)20-18(17)21/h4-11,17,19H,1-3H3,(H,20,21).
What are the key properties of 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one?
5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one has a molecular weight of 280.37 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-propan-2-ylanilino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43192468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).