(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide

C9H15N3O2S — CID 93274619

IUPAC(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C1N[C@H](C(=O)NC2CCNCC2)CS1
InChIInChI=1S/C9H15N3O2S/c13-8(7-5-15-9(14)12-7)11-6-1-3-10-4-2-6/h6-7,10H,1-5H2,(H,11,13)(H,12,14)/t7-/m0/s1
InChIKeyCCSMDGTWDMUNQK-ZETCQYMHSA-N
MW229.30 g/mol
LogP-0.32
Rot. Bonds2

About (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide

(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide (PubChem CID 93274619) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide
PubChem CID93274619
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C1N[C@H](C(=O)NC2CCNCC2)CS1
InChIInChI=1S/C9H15N3O2S/c13-8(7-5-15-9(14)12-7)11-6-1-3-10-4-2-6/h6-7,10H,1-5H2,(H,11,13)(H,12,14)/t7-/m0/s1
InChIKeyCCSMDGTWDMUNQK-ZETCQYMHSA-N
XLogP-0.32
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide (CID 93274619) is (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide is O=C1N[C@H](C(=O)NC2CCNCC2)CS1.
What is the InChIKey of (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide?
The InChIKey is CCSMDGTWDMUNQK-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H15N3O2S/c13-8(7-5-15-9(14)12-7)11-6-1-3-10-4-2-6/h6-7,10H,1-5H2,(H,11,13)(H,12,14)/t7-/m0/s1.
What are the key properties of (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide?
(4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide has a molecular weight of 229.30 g/mol, XLogP of -0.32, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-oxo-N-piperidin-4-yl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 93274619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).