[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone

C13H16N2O4S — CID 42745661

IUPAC[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CSCN1C(=O)c1ccco1)N1CCOCC1
InChIInChI=1S/C13H16N2O4S/c16-12(14-3-6-18-7-4-14)10-8-20-9-15(10)13(17)11-2-1-5-19-11/h1-2,5,10H,3-4,6-9H2
InChIKeySGJKTBXUSYWECK-UHFFFAOYSA-N
MW296.35 g/mol
LogP0.65
Rot. Bonds2

About [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone

[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 42745661) has the molecular formula C13H16N2O4S and a molecular weight of 296.35 g/mol. Its IUPAC name is [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
PubChem CID42745661
Molecular FormulaC13H16N2O4S
Molecular Weight296.35 g/mol
Exact Mass296.08
IUPAC Name[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CSCN1C(=O)c1ccco1)N1CCOCC1
InChIInChI=1S/C13H16N2O4S/c16-12(14-3-6-18-7-4-14)10-8-20-9-15(10)13(17)11-2-1-5-19-11/h1-2,5,10H,3-4,6-9H2
InChIKeySGJKTBXUSYWECK-UHFFFAOYSA-N
XLogP0.65
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

benzyl (4R)-4-(morpholine-4-carbonyl)-1,3-thiazolidine-3-carboxylate
CID 14556728
[3-(furan-2-carbonyl)-2-propyl-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone
CID 42749192
1-[4-(furan-2-carbonyl)piperazin-1-yl]-3-morpholin-4-ylpropane-1,3-dione
CID 108943477
3-(furan-2-carbonyl)-N-(1-phenylethyl)-1,3-thiazolidine-4-carboxamide
CID 4030871
N-(3,4-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 3398465
(4S)-N-(2,3-dimethylphenyl)-3-(furan-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95316914
4-[4-(pyrrolidine-1-carbonyl)-1,3-thiazolidine-3-carbonyl]benzoic acid
CID 119183486
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
azepan-1-yl-[(3R)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone
CID 51708187
6-(3-benzoyl-1,3-thiazolidine-4-carbonyl)-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119174920
N-[2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-2-oxoethyl]furan-2-carboxamide
CID 38491111
1-(3-benzoyl-1,3-thiazolidine-4-carbonyl)-4-hydroxypiperidine-4-carboxylic acid
CID 119251290

Frequently Asked Questions

What is the IUPAC name of [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone (CID 42745661) is [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CSCN1C(=O)c1ccco1)N1CCOCC1.
What is the InChIKey of [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is SGJKTBXUSYWECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4S/c16-12(14-3-6-18-7-4-14)10-8-20-9-15(10)13(17)11-2-1-5-19-11/h1-2,5,10H,3-4,6-9H2.
What are the key properties of [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone?
[3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 296.35 g/mol, XLogP of 0.65, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(furan-2-carbonyl)-1,3-thiazolidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 42745661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).