N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide

C17H20N2O3S2 — CID 42745033

IUPACN-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCCC(C)NC(=O)C1CSC(c2ccoc2)N1C(=O)c1cccs1
InChIInChI=1S/C17H20N2O3S2/c1-3-11(2)18-15(20)13-10-24-17(12-6-7-22-9-12)19(13)16(21)14-5-4-8-23-14/h4-9,11,13,17H,3,10H2,1-2H3,(H,18,20)
InChIKeyFDTXHAZNAJCNQM-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.51
Rot. Bonds5

About N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide

N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 42745033) has the molecular formula C17H20N2O3S2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
PubChem CID42745033
Molecular FormulaC17H20N2O3S2
Molecular Weight364.49 g/mol
Exact Mass364.09
IUPAC NameN-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCCC(C)NC(=O)C1CSC(c2ccoc2)N1C(=O)c1cccs1
InChIInChI=1S/C17H20N2O3S2/c1-3-11(2)18-15(20)13-10-24-17(12-6-7-22-9-12)19(13)16(21)14-5-4-8-23-14/h4-9,11,13,17H,3,10H2,1-2H3,(H,18,20)
InChIKeyFDTXHAZNAJCNQM-UHFFFAOYSA-N
XLogP3.51
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(furan-3-yl)-N-(3-methylbutyl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 5033600
N-butan-2-yl-2-ethyl-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 42749131
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
3-benzoyl-2-(furan-3-yl)-N-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42745107
3-(4-fluorobenzoyl)-2-(furan-3-yl)-N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 42745146
3-acetyl-2-(furan-3-yl)-N-(3-methylbutyl)-1,3-thiazolidine-4-carboxamide
CID 42744972
N-(1-phenylethyl)-2-propyl-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide
CID 5029074
3-acetyl-N-benzyl-2-(furan-3-yl)-1,3-thiazolidine-4-carboxamide
CID 42744957
N-benzhydryl-2-(furan-3-yl)-3-(3,4,5-trimethoxybenzoyl)-1,3-thiazolidine-4-carboxamide
CID 42749369
(2R,4R)-3-(2-chlorobenzoyl)-2-(furan-3-yl)-N-hexyl-1,3-thiazolidine-4-carboxamide
CID 7356695
N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide
CID 42744943

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide (CID 42745033) is N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide is CCC(C)NC(=O)C1CSC(c2ccoc2)N1C(=O)c1cccs1.
What is the InChIKey of N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is FDTXHAZNAJCNQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S2/c1-3-11(2)18-15(20)13-10-24-17(12-6-7-22-9-12)19(13)16(21)14-5-4-8-23-14/h4-9,11,13,17H,3,10H2,1-2H3,(H,18,20).
What are the key properties of N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide?
N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(furan-3-yl)-3-(thiophene-2-carbonyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 42745033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).