N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

C17H19N3O2S — CID 20931286

IUPACN-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCc1ccc2c(c1)C(C)(C)C(=O)N2CC(=O)Nc1nc(C)cs1
InChIInChI=1S/C17H19N3O2S/c1-10-5-6-13-12(7-10)17(3,4)15(22)20(13)8-14(21)19-16-18-11(2)9-23-16/h5-7,9H,8H2,1-4H3,(H,18,19,21)
InChIKeyYPCOUIGQTSFMCR-UHFFFAOYSA-N
MW329.43 g/mol
LogP3.02
Rot. Bonds3

About N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (PubChem CID 20931286) has the molecular formula C17H19N3O2S and a molecular weight of 329.43 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
PubChem CID20931286
Molecular FormulaC17H19N3O2S
Molecular Weight329.43 g/mol
Exact Mass329.12
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCc1ccc2c(c1)C(C)(C)C(=O)N2CC(=O)Nc1nc(C)cs1
InChIInChI=1S/C17H19N3O2S/c1-10-5-6-13-12(7-10)17(3,4)15(22)20(13)8-14(21)19-16-18-11(2)9-23-16/h5-7,9H,8H2,1-4H3,(H,18,19,21)
InChIKeyYPCOUIGQTSFMCR-UHFFFAOYSA-N
XLogP3.02
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.43
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (CID 20931286) is N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is Cc1ccc2c(c1)C(C)(C)C(=O)N2CC(=O)Nc1nc(C)cs1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The InChIKey is YPCOUIGQTSFMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2S/c1-10-5-6-13-12(7-10)17(3,4)15(22)20(13)8-14(21)19-16-18-11(2)9-23-16/h5-7,9H,8H2,1-4H3,(H,18,19,21).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide has a molecular weight of 329.43 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is sourced from PubChem (CID 20931286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).