3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide

C19H22N2O2S — CID 110784091

IUPAC3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide
SMILESCN1C(=O)C(C)(C)c2cc(CNC(=O)CCc3cccs3)ccc21
InChIInChI=1S/C19H22N2O2S/c1-19(2)15-11-13(6-8-16(15)21(3)18(19)23)12-20-17(22)9-7-14-5-4-10-24-14/h4-6,8,10-11H,7,9,12H2,1-3H3,(H,20,22)
InChIKeySPFSLBHYJNRWDK-UHFFFAOYSA-N
MW342.46 g/mol
LogP3.25
Rot. Bonds5

About 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide

3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide (PubChem CID 110784091) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide
PubChem CID110784091
Molecular FormulaC19H22N2O2S
Molecular Weight342.46 g/mol
Exact Mass342.14
IUPAC Name3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide
SMILESCN1C(=O)C(C)(C)c2cc(CNC(=O)CCc3cccs3)ccc21
InChIInChI=1S/C19H22N2O2S/c1-19(2)15-11-13(6-8-16(15)21(3)18(19)23)12-20-17(22)9-7-14-5-4-10-24-14/h4-6,8,10-11H,7,9,12H2,1-3H3,(H,20,22)
InChIKeySPFSLBHYJNRWDK-UHFFFAOYSA-N
XLogP3.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.46
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-thiophen-2-yl-N-[2-(1,3,3-trimethyl-2-oxoindol-5-yl)ethyl]acetamide
CID 110790343
N-[(4-methyl-3-oxo-1,4-benzoxazin-6-yl)methyl]-3-thiophen-2-ylpropanamide
CID 110783577
N-[(4-fluorophenyl)methyl]-2-(1,3,3-trimethyl-2-oxoindol-5-yl)acetamide
CID 110771024
N-[2-(1,3,3-trimethyl-2-oxoindol-5-yl)ethyl]pentanamide
CID 110790328
N-[(3-bromophenyl)methyl]-3-thiophen-2-ylpropanamide
CID 52570732
N-(1,3-benzodioxol-5-ylmethyl)-3-thiophen-2-ylpropanamide
CID 9112024
N-[(3,5-dimethoxyphenyl)methyl]-3-thiophen-2-ylpropanamide
CID 52570846
N-(thiophen-2-ylmethyl)-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]benzamide
CID 20903323
N-[[3-(methylsulfamoyl)phenyl]methyl]-3-thiophen-2-ylpropanamide
CID 34640507
N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-3-thiophen-2-ylpropanamide
CID 110730380
N-[2-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)ethyl]-3-thiophen-2-ylpropanamide
CID 110790010
N-[(4-methylphenyl)methyl]-5-thiophen-2-ylpentanamide
CID 4290554

Frequently Asked Questions

What is the IUPAC name of 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide?
The IUPAC name of 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide (CID 110784091) is 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide.
What is the SMILES notation for 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide?
The canonical SMILES for 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide is CN1C(=O)C(C)(C)c2cc(CNC(=O)CCc3cccs3)ccc21.
What is the InChIKey of 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide?
The InChIKey is SPFSLBHYJNRWDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2S/c1-19(2)15-11-13(6-8-16(15)21(3)18(19)23)12-20-17(22)9-7-14-5-4-10-24-14/h4-6,8,10-11H,7,9,12H2,1-3H3,(H,20,22).
What are the key properties of 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide?
3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide has a molecular weight of 342.46 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-2-yl-N-[(1,3,3-trimethyl-2-oxoindol-5-yl)methyl]propanamide is sourced from PubChem (CID 110784091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).