3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

C10H14N2O4S — CID 66030110

IUPAC3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C1NC(C(=O)NC2CCC(C(=O)O)C2)CS1
InChIInChI=1S/C10H14N2O4S/c13-8(7-4-17-10(16)12-7)11-6-2-1-5(3-6)9(14)15/h5-7H,1-4H2,(H,11,13)(H,12,16)(H,14,15)
InChIKeyRJBCFVPWPWXBCZ-UHFFFAOYSA-N
MW258.30 g/mol
LogP0.18
Rot. Bonds3

About 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid

3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 66030110) has the molecular formula C10H14N2O4S and a molecular weight of 258.30 g/mol. Its IUPAC name is 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
PubChem CID66030110
Molecular FormulaC10H14N2O4S
Molecular Weight258.30 g/mol
Exact Mass258.07
IUPAC Name3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
SMILESO=C1NC(C(=O)NC2CCC(C(=O)O)C2)CS1
InChIInChI=1S/C10H14N2O4S/c13-8(7-4-17-10(16)12-7)11-6-2-1-5(3-6)9(14)15/h5-7H,1-4H2,(H,11,13)(H,12,16)(H,14,15)
InChIKeyRJBCFVPWPWXBCZ-UHFFFAOYSA-N
XLogP0.18
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thioester', 'substructure': 'N/A'}

Analyze 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid 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

(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide
CID 93274619
4-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopent-2-ene-1-carboxylic acid
CID 79209096
3-(cyclopropylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549764
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
cis-(1R,3S)-3-[(6-oxopiperidine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321143
cis-(1S,3R)-3-[[(1S,2R)-2-methylcyclopropanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 97030816
cis-(1R,3S)-3-[[4-(cyclopentanecarbonylamino)cyclohexanecarbonyl]amino]cyclopentane-1-carboxylic acid
CID 120679065
3-(2,3-dihydro-1H-indole-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 77110035
N-(cyclopropylmethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 130977762
3-(thiolan-3-ylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 103064106
3-(7-azabicyclo[2.2.1]heptane-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 66031370
(4S)-N-[(3S,5R)-1-benzyl-3,5-dimethylpiperidin-4-yl]-2-oxo-1,3-thiazolidine-4-carboxamide
CID 124780262

Frequently Asked Questions

What is the IUPAC name of 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid (CID 66030110) is 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is O=C1NC(C(=O)NC2CCC(C(=O)O)C2)CS1.
What is the InChIKey of 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is RJBCFVPWPWXBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S/c13-8(7-4-17-10(16)12-7)11-6-2-1-5(3-6)9(14)15/h5-7H,1-4H2,(H,11,13)(H,12,16)(H,14,15).
What are the key properties of 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid?
3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 258.30 g/mol, XLogP of 0.18, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-oxo-1,3-thiazolidine-4-carbonyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66030110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).