3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide

C17H25N3O3S — CID 42744965

IUPAC3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(=O)N1C(C(=O)NCCN2CCCCC2)CSC1c1ccoc1
InChIInChI=1S/C17H25N3O3S/c1-13(21)20-15(12-24-17(20)14-5-10-23-11-14)16(22)18-6-9-19-7-3-2-4-8-19/h5,10-11,15,17H,2-4,6-9,12H2,1H3,(H,18,22)
InChIKeyMOISWJVNJNQWFH-UHFFFAOYSA-N
MW351.47 g/mol
LogP1.84
Rot. Bonds5

About 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide

3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 42744965) has the molecular formula C17H25N3O3S and a molecular weight of 351.47 g/mol. Its IUPAC name is 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
PubChem CID42744965
Molecular FormulaC17H25N3O3S
Molecular Weight351.47 g/mol
Exact Mass351.16
IUPAC Name3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(=O)N1C(C(=O)NCCN2CCCCC2)CSC1c1ccoc1
InChIInChI=1S/C17H25N3O3S/c1-13(21)20-15(12-24-17(20)14-5-10-23-11-14)16(22)18-6-9-19-7-3-2-4-8-19/h5,10-11,15,17H,2-4,6-9,12H2,1H3,(H,18,22)
InChIKeyMOISWJVNJNQWFH-UHFFFAOYSA-N
XLogP1.84
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.47
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-fluorobenzoyl)-2-(furan-3-yl)-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 42745136
3-acetyl-2-(furan-3-yl)-N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide
CID 42744972
3-acetyl-N-benzyl-2-(furan-3-yl)-1,3-thiazolidine-4-carboxamide
CID 42744957
2-(furan-3-yl)-N-(2-morpholin-4-ylethyl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 42745041
3-acetyl-2-(furan-3-yl)-N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 42744974
2-(4-fluorophenyl)-3-(4-methylbenzoyl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 3997234
(2S,4R)-2-(3,4-dimethoxyphenyl)-3-propanoyl-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 7271182
3-(4-chlorobenzoyl)-2-(3-fluorophenyl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 4542964
2-(furan-3-yl)-N-(2-methoxyethyl)-3-(4-methylbenzoyl)-1,3-thiazolidine-4-carboxamide
CID 42745217
(2R,4R)-3-(2-chlorobenzoyl)-2-(furan-3-yl)-N-hexyl-1,3-thiazolidine-4-carboxamide
CID 7356695
3-(furan-2-carbonyl)-N-(2-piperidin-1-ylethyl)-2-propan-2-yl-1,3-thiazolidine-4-carboxamide
CID 42744800
2-(furan-3-yl)-N-(3-methylbutyl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 5033600

Frequently Asked Questions

What is the IUPAC name of 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide (CID 42744965) is 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide is CC(=O)N1C(C(=O)NCCN2CCCCC2)CSC1c1ccoc1.
What is the InChIKey of 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is MOISWJVNJNQWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3S/c1-13(21)20-15(12-24-17(20)14-5-10-23-11-14)16(22)18-6-9-19-7-3-2-4-8-19/h5,10-11,15,17H,2-4,6-9,12H2,1H3,(H,18,22).
What are the key properties of 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide?
3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 351.47 g/mol, XLogP of 1.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetyl-2-(furan-3-yl)-N-(2-piperidin-1-ylethyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 42744965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).