6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one

C15H18N2O2S — CID 102712422

IUPAC6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
SMILESCC1CN(C(=O)c2ccc3c(c2)NC(=O)C3)CC(C)S1
InChIInChI=1S/C15H18N2O2S/c1-9-7-17(8-10(2)20-9)15(19)12-4-3-11-6-14(18)16-13(11)5-12/h3-5,9-10H,6-8H2,1-2H3,(H,16,18)
InChIKeyBZKMPRIFGPRDKP-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.15
Rot. Bonds1

About 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one

6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one (PubChem CID 102712422) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
PubChem CID102712422
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
SMILESCC1CN(C(=O)c2ccc3c(c2)NC(=O)C3)CC(C)S1
InChIInChI=1S/C15H18N2O2S/c1-9-7-17(8-10(2)20-9)15(19)12-4-3-11-6-14(18)16-13(11)5-12/h3-5,9-10H,6-8H2,1-2H3,(H,16,18)
InChIKeyBZKMPRIFGPRDKP-UHFFFAOYSA-N
XLogP2.15
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-methylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
CID 102712777
6-(3-methylpiperazine-1-carbonyl)-1,3-dihydroindol-2-one
CID 102711587
4-(2-oxo-1,3-dihydroindole-6-carbonyl)piperazine-2,6-dione
CID 102712523
6-(4-amino-3-methylpiperidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 102711641
N-[1-(2-oxo-1,3-dihydroindole-6-carbonyl)pyrrolidin-3-yl]acetamide
CID 102712694
6-(4-ethyl-4-methylpiperidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 102712356
6-[4-(aminomethyl)piperidine-1-carbonyl]-1,3-dihydroindol-2-one
CID 102711454
5-(3-amino-4-methylpyrrolidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 103575914
6-(3,5-dimethylpiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 86911989
5-(3,4-dimethylpiperazine-1-carbonyl)-1,3-dihydroindol-2-one
CID 103725306
2-oxo-1,3-dihydroindole-6-carbonyl chloride
CID 141361971
6-acetyl-1,3-dihydroindol-2-one;molecular hydrogen
CID 162521220

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one?
The IUPAC name of 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one (CID 102712422) is 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one is CC1CN(C(=O)c2ccc3c(c2)NC(=O)C3)CC(C)S1.
What is the InChIKey of 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one?
The InChIKey is BZKMPRIFGPRDKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-9-7-17(8-10(2)20-9)15(19)12-4-3-11-6-14(18)16-13(11)5-12/h3-5,9-10H,6-8H2,1-2H3,(H,16,18).
What are the key properties of 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one?
6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one has a molecular weight of 290.39 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylthiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 102712422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).