N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide

C15H20N2O2S — CID 71957835

IUPACN,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
SMILESCc1ccccc1C1SCC(=O)N1C(C)C(=O)N(C)C
InChIInChI=1S/C15H20N2O2S/c1-10-7-5-6-8-12(10)15-17(13(18)9-20-15)11(2)14(19)16(3)4/h5-8,11,15H,9H2,1-4H3
InChIKeyBFQOFGXFQMLYGW-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.05
Rot. Bonds3

About N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide

N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide (PubChem CID 71957835) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
PubChem CID71957835
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC NameN,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
SMILESCc1ccccc1C1SCC(=O)N1C(C)C(=O)N(C)C
InChIInChI=1S/C15H20N2O2S/c1-10-7-5-6-8-12(10)15-17(13(18)9-20-15)11(2)14(19)16(3)4/h5-8,11,15H,9H2,1-4H3
InChIKeyBFQOFGXFQMLYGW-UHFFFAOYSA-N
XLogP2.05
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The IUPAC name of N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide (CID 71957835) is N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The canonical SMILES for N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide is Cc1ccccc1C1SCC(=O)N1C(C)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The InChIKey is BFQOFGXFQMLYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-10-7-5-6-8-12(10)15-17(13(18)9-20-15)11(2)14(19)16(3)4/h5-8,11,15H,9H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide has a molecular weight of 292.40 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide is sourced from PubChem (CID 71957835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).