2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid

C16H24N2O5S — CID 119249033

IUPAC2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid
SMILESO=C(O)CC1CN(C(=O)C2CSCN2C(=O)C2CCCC2)CCO1
InChIInChI=1S/C16H24N2O5S/c19-14(20)7-12-8-17(5-6-23-12)16(22)13-9-24-10-18(13)15(21)11-3-1-2-4-11/h11-13H,1-10H2,(H,19,20)
InChIKeyRFDRAIFGUFIFKL-UHFFFAOYSA-N
MW356.44 g/mol
LogP0.78
Rot. Bonds4

About 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid

2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid (PubChem CID 119249033) has the molecular formula C16H24N2O5S and a molecular weight of 356.44 g/mol. Its IUPAC name is 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid
PubChem CID119249033
Molecular FormulaC16H24N2O5S
Molecular Weight356.44 g/mol
Exact Mass356.14
IUPAC Name2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid
SMILESO=C(O)CC1CN(C(=O)C2CSCN2C(=O)C2CCCC2)CCO1
InChIInChI=1S/C16H24N2O5S/c19-14(20)7-12-8-17(5-6-23-12)16(22)13-9-24-10-18(13)15(21)11-3-1-2-4-11/h11-13H,1-10H2,(H,19,20)
InChIKeyRFDRAIFGUFIFKL-UHFFFAOYSA-N
XLogP0.78
TPSA87.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.44
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

cyclohexyl-[4-(pyrrolidine-1-carbonyl)-1,3-thiazolidin-3-yl]methanone
CID 42744639
2-[4-[1-(pyrrolidine-1-carbonyl)piperidine-4-carbonyl]morpholin-2-yl]acetic acid
CID 119248813
cyclopentyl-[4-(thiomorpholine-4-carbonyl)-1,3-thiazolidin-3-yl]methanone
CID 71935072
2-[(2S)-4-[(3S)-oxane-3-carbonyl]morpholin-2-yl]acetic acid
CID 124515362
cyclopropyl-[4-(pyrrolidine-1-carbonyl)-1,3-thiazolidin-3-yl]methanone
CID 42745619
cyclopentyl-[4-[3-(methylaminomethyl)piperidine-1-carbonyl]-1,3-thiazolidin-3-yl]methanone
CID 119396252
2-[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carbonyl)morpholin-2-yl]acetic acid
CID 120527755
2-[4-[(3R)-piperidine-3-carbonyl]morpholin-2-yl]acetic acid
CID 81134829
[4-(4-aminopiperidine-1-carbonyl)-1,3-thiazolidin-3-yl]-cyclopentylmethanone;hydrochloride
CID 119374240
2-[4-(1-methylpyrrolidine-3-carbonyl)morpholin-2-yl]acetic acid
CID 66420578
[(4R)-4-[(9aS)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine-2-carbonyl]-1,3-thiazolidin-3-yl]-cyclobutylmethanone
CID 124801732
2-[4-(2-cyclohexylcyclopropanecarbonyl)morpholin-2-yl]acetic acid
CID 119248477

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid (CID 119249033) is 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid is O=C(O)CC1CN(C(=O)C2CSCN2C(=O)C2CCCC2)CCO1.
What is the InChIKey of 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid?
The InChIKey is RFDRAIFGUFIFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O5S/c19-14(20)7-12-8-17(5-6-23-12)16(22)13-9-24-10-18(13)15(21)11-3-1-2-4-11/h11-13H,1-10H2,(H,19,20).
What are the key properties of 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid?
2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid has a molecular weight of 356.44 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carbonyl]morpholin-2-yl]acetic acid is sourced from PubChem (CID 119249033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).