3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide

C17H18N2O3S — CID 75434211

IUPAC3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1cccc(-c2ccoc2)c1
InChIInChI=1S/C17H18N2O3S/c1-18(2)17(21)15-10-23-11-19(15)16(20)13-5-3-4-12(8-13)14-6-7-22-9-14/h3-9,15H,10-11H2,1-2H3
InChIKeyQDPKXYWRZGSYIG-UHFFFAOYSA-N
MW330.41 g/mol
LogP2.55
Rot. Bonds3

About 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide

3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide (PubChem CID 75434211) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
PubChem CID75434211
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC Name3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1cccc(-c2ccoc2)c1
InChIInChI=1S/C17H18N2O3S/c1-18(2)17(21)15-10-23-11-19(15)16(20)13-5-3-4-12(8-13)14-6-7-22-9-14/h3-9,15H,10-11H2,1-2H3
InChIKeyQDPKXYWRZGSYIG-UHFFFAOYSA-N
XLogP2.55
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 136518419
3-[3-(dimethylamino)benzoyl]-1,3-thiazolidine-4-carboxylic acid
CID 43329177
(4R)-3-(2,3-dichlorobenzoyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
CID 95174306
(4S)-3-(1-acetyl-2,3-dihydroindole-5-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
CID 95174264
3-(1-benzothiophene-2-carbonyl)-N,N-dimethyl-1,3-thiazolidine-4-carboxamide
CID 71879816
(4S)-N,N-dimethyl-3-(5-nitrofuran-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 95174309
(4S)-3-benzoyl-1,3-thiazolidine-4-carboxylic acid
CID 11882190
3-(3-methylsulfonylbenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 43099503
3-(3-acetamidobenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 43359495
(4R)-3-(3-methylsulfonylbenzoyl)-1,3-thiazolidine-4-carboxylic acid
CID 29045368
4-[(3-benzoyl-1,3-thiazolidine-4-carbonyl)-methylamino]butanoic acid
CID 119172932
(4R)-3-(1,3-benzodioxole-5-carbonyl)-N,N-diethyl-1,3-thiazolidine-4-carboxamide
CID 95159279

Frequently Asked Questions

What is the IUPAC name of 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide (CID 75434211) is 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide is CN(C)C(=O)C1CSCN1C(=O)c1cccc(-c2ccoc2)c1.
What is the InChIKey of 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
The InChIKey is QDPKXYWRZGSYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-18(2)17(21)15-10-23-11-19(15)16(20)13-5-3-4-12(8-13)14-6-7-22-9-14/h3-9,15H,10-11H2,1-2H3.
What are the key properties of 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide?
3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide has a molecular weight of 330.41 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(furan-3-yl)benzoyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 75434211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).