1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone

C10H16F3N3OS — CID 61260157

IUPAC1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
SMILESO=C(C1CSCN1)N1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C10H16F3N3OS/c11-10(12,13)6-15-1-3-16(4-2-15)9(17)8-5-18-7-14-8/h8,14H,1-7H2
InChIKeyGSJOUIVQIJSXHD-UHFFFAOYSA-N
MW283.32 g/mol
LogP0.36
Rot. Bonds2

About 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone

1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone (PubChem CID 61260157) has the molecular formula C10H16F3N3OS and a molecular weight of 283.32 g/mol. Its IUPAC name is 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
PubChem CID61260157
Molecular FormulaC10H16F3N3OS
Molecular Weight283.32 g/mol
Exact Mass283.10
IUPAC Name1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
SMILESO=C(C1CSCN1)N1CCN(CC(F)(F)F)CC1
InChIInChI=1S/C10H16F3N3OS/c11-10(12,13)6-15-1-3-16(4-2-15)9(17)8-5-18-7-14-8/h8,14H,1-7H2
InChIKeyGSJOUIVQIJSXHD-UHFFFAOYSA-N
XLogP0.36
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone?
The IUPAC name of 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone (CID 61260157) is 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone.
What is the SMILES notation for 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone?
The canonical SMILES for 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone is O=C(C1CSCN1)N1CCN(CC(F)(F)F)CC1.
What is the InChIKey of 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone?
The InChIKey is GSJOUIVQIJSXHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3OS/c11-10(12,13)6-15-1-3-16(4-2-15)9(17)8-5-18-7-14-8/h8,14H,1-7H2.
What are the key properties of 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone?
1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone has a molecular weight of 283.32 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 61260157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).