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

C10H17N3O3S — CID 47035847

IUPACN,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CN1CSCC1=O)C(=O)N(C)C
InChIInChI=1S/C10H17N3O3S/c1-7(10(16)12(2)3)11-8(14)4-13-6-17-5-9(13)15/h7H,4-6H2,1-3H3,(H,11,14)
InChIKeySGTZVDDPNZMWJI-UHFFFAOYSA-N
MW259.33 g/mol
LogP-0.89
Rot. Bonds4

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

N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide (PubChem CID 47035847) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide
PubChem CID47035847
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC NameN,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide
SMILESCC(NC(=O)CN1CSCC1=O)C(=O)N(C)C
InChIInChI=1S/C10H17N3O3S/c1-7(10(16)12(2)3)11-8(14)4-13-6-17-5-9(13)15/h7H,4-6H2,1-3H3,(H,11,14)
InChIKeySGTZVDDPNZMWJI-UHFFFAOYSA-N
XLogP-0.89
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 5-0.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide?
The IUPAC name of N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide (CID 47035847) is N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide is CC(NC(=O)CN1CSCC1=O)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide?
The InChIKey is SGTZVDDPNZMWJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-7(10(16)12(2)3)11-8(14)4-13-6-17-5-9(13)15/h7H,4-6H2,1-3H3,(H,11,14).
What are the key properties of N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide?
N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide has a molecular weight of 259.33 g/mol, XLogP of -0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]propanamide is sourced from PubChem (CID 47035847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).