[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone

C16H24N2O4S — CID 126800076

IUPAC[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone
SMILESCC(C)c1ccoc1C(=O)N1CCCC(N2CCCS2(=O)=O)C1
InChIInChI=1S/C16H24N2O4S/c1-12(2)14-6-9-22-15(14)16(19)17-7-3-5-13(11-17)18-8-4-10-23(18,20)21/h6,9,12-13H,3-5,7-8,10-11H2,1-2H3
InChIKeyFUCHZECJPJMGKK-UHFFFAOYSA-N
MW340.44 g/mol
LogP2.04
Rot. Bonds3

About [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone

[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone (PubChem CID 126800076) has the molecular formula C16H24N2O4S and a molecular weight of 340.44 g/mol. Its IUPAC name is [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone.

Molecular Properties

Compound Name[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone
PubChem CID126800076
Molecular FormulaC16H24N2O4S
Molecular Weight340.44 g/mol
Exact Mass340.15
IUPAC Name[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone
SMILESCC(C)c1ccoc1C(=O)N1CCCC(N2CCCS2(=O)=O)C1
InChIInChI=1S/C16H24N2O4S/c1-12(2)14-6-9-22-15(14)16(19)17-7-3-5-13(11-17)18-8-4-10-23(18,20)21/h6,9,12-13H,3-5,7-8,10-11H2,1-2H3
InChIKeyFUCHZECJPJMGKK-UHFFFAOYSA-N
XLogP2.04
TPSA70.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.44
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-propan-2-ylfuran-2-yl)-(4-pyrrolidin-1-ylazepan-1-yl)methanone
CID 136541221
1-benzofuran-3-yl-[(3R)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]methanone
CID 124884002
3,4-dihydro-2H-pyran-6-yl-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]methanone
CID 122139579
(5-chloro-6-ethoxy-3-pyridinyl)-[(3R)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]methanone
CID 100732935
5-[1-(3-propan-2-ylfuran-2-carbonyl)piperidin-4-yl]-1,3-oxazole-4-carboxylic acid
CID 138009560
(3-chloropiperidin-1-yl)-(3-methylfuran-2-yl)methanone
CID 63393139
1-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-2-(3-phenylpropylsulfonyl)ethanone
CID 119039974
1-[(3S)-3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-2-(3-phenylpropylsulfonyl)ethanone
CID 100732905
3-[(3aR,6aS)-3a,6a-dimethyl-5-(3-propan-2-ylfuran-2-carbonyl)-1,3,4,6-tetrahydropyrrolo[3,4-c]pyrrol-2-yl]-1-methylpyrrolidin-2-one
CID 167800137
N-[(4-cyano-3-fluorophenyl)methyl]-3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide
CID 128632274
(3-aminopiperidin-1-yl)-(3-methylfuran-2-yl)methanone;hydrochloride
CID 119377765
1-[(3S)-1-(3-methylfuran-2-carbonyl)piperidin-3-yl]pyrazole-4-carboxylic acid
CID 97332238

Frequently Asked Questions

What is the IUPAC name of [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone?
The IUPAC name of [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone (CID 126800076) is [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone.
What is the SMILES notation for [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone?
The canonical SMILES for [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone is CC(C)c1ccoc1C(=O)N1CCCC(N2CCCS2(=O)=O)C1.
What is the InChIKey of [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone?
The InChIKey is FUCHZECJPJMGKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4S/c1-12(2)14-6-9-22-15(14)16(19)17-7-3-5-13(11-17)18-8-4-10-23(18,20)21/h6,9,12-13H,3-5,7-8,10-11H2,1-2H3.
What are the key properties of [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone?
[3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone has a molecular weight of 340.44 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-propan-2-ylfuran-2-yl)methanone is sourced from PubChem (CID 126800076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).