3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

C14H18N2O3S2 — CID 42815161

IUPAC3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCC(C(=O)N1CCOCC1)N1C(=O)CSC1c1cccs1
InChIInChI=1S/C14H18N2O3S2/c1-10(13(18)15-4-6-19-7-5-15)16-12(17)9-21-14(16)11-3-2-8-20-11/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyRCOGOXFFFZYMIC-UHFFFAOYSA-N
MW326.44 g/mol
LogP1.57
Rot. Bonds3

About 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (PubChem CID 42815161) has the molecular formula C14H18N2O3S2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
PubChem CID42815161
Molecular FormulaC14H18N2O3S2
Molecular Weight326.44 g/mol
Exact Mass326.08
IUPAC Name3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESCC(C(=O)N1CCOCC1)N1C(=O)CSC1c1cccs1
InChIInChI=1S/C14H18N2O3S2/c1-10(13(18)15-4-6-19-7-5-15)16-12(17)9-21-14(16)11-3-2-8-20-11/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyRCOGOXFFFZYMIC-UHFFFAOYSA-N
XLogP1.57
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (CID 42815161) is 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is CC(C(=O)N1CCOCC1)N1C(=O)CSC1c1cccs1.
What is the InChIKey of 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The InChIKey is RCOGOXFFFZYMIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S2/c1-10(13(18)15-4-6-19-7-5-15)16-12(17)9-21-14(16)11-3-2-8-20-11/h2-3,8,10,14H,4-7,9H2,1H3.
What are the key properties of 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one has a molecular weight of 326.44 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 42815161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).