2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide

C11H20N2O3S — CID 59766517

IUPAC2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide
SMILESCCCOCCNC(=O)C1CSC(C(C)=O)N1
InChIInChI=1S/C11H20N2O3S/c1-3-5-16-6-4-12-10(15)9-7-17-11(13-9)8(2)14/h9,11,13H,3-7H2,1-2H3,(H,12,15)
InChIKeyOOMNVKDMAVXQBR-UHFFFAOYSA-N
MW260.36 g/mol
LogP0.15
Rot. Bonds7

About 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide

2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 59766517) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide
PubChem CID59766517
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC Name2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide
SMILESCCCOCCNC(=O)C1CSC(C(C)=O)N1
InChIInChI=1S/C11H20N2O3S/c1-3-5-16-6-4-12-10(15)9-7-17-11(13-9)8(2)14/h9,11,13H,3-7H2,1-2H3,(H,12,15)
InChIKeyOOMNVKDMAVXQBR-UHFFFAOYSA-N
XLogP0.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide 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

N-(2-ethoxyethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119280656
N-(3-propoxypropyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
CID 82940665
molecular hydrogen;N-(2-propoxyethyl)propanamide
CID 170639851
N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
CID 171823735
2-bromo-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 90995903
N-(2-butoxyethyl)piperazine-2-carboxamide
CID 63103640
(E)-4-oxo-N-(2-propoxyethyl)pent-2-enamide
CID 167491660
(E)-5-methyl-4-oxo-N-(2-propoxyethyl)hex-2-enamide
CID 178008368
2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethylcarbamic acid
CID 123981606
N-(2-ethoxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119280657
N-[2-(2-hydroxyethoxy)ethyl]thiomorpholine-3-carboxamide
CID 82908917

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide (CID 59766517) is 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide is CCCOCCNC(=O)C1CSC(C(C)=O)N1.
What is the InChIKey of 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is OOMNVKDMAVXQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-3-5-16-6-4-12-10(15)9-7-17-11(13-9)8(2)14/h9,11,13H,3-7H2,1-2H3,(H,12,15).
What are the key properties of 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide?
2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 260.36 g/mol, XLogP of 0.15, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-(2-propoxyethyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 59766517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).