N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide

C17H17FN2O3S — CID 42744943

IUPACN-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide
SMILESCCC(=O)N1C(C(=O)Nc2ccccc2F)CSC1c1ccoc1
InChIInChI=1S/C17H17FN2O3S/c1-2-15(21)20-14(10-24-17(20)11-7-8-23-9-11)16(22)19-13-6-4-3-5-12(13)18/h3-9,14,17H,2,10H2,1H3,(H,19,22)
InChIKeyNHDYTYQOHYXIOF-UHFFFAOYSA-N
MW348.40 g/mol
LogP3.41
Rot. Bonds4

About N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide

N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide (PubChem CID 42744943) has the molecular formula C17H17FN2O3S and a molecular weight of 348.40 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide
PubChem CID42744943
Molecular FormulaC17H17FN2O3S
Molecular Weight348.40 g/mol
Exact Mass348.09
IUPAC NameN-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide
SMILESCCC(=O)N1C(C(=O)Nc2ccccc2F)CSC1c1ccoc1
InChIInChI=1S/C17H17FN2O3S/c1-2-15(21)20-14(10-24-17(20)11-7-8-23-9-11)16(22)19-13-6-4-3-5-12(13)18/h3-9,14,17H,2,10H2,1H3,(H,19,22)
InChIKeyNHDYTYQOHYXIOF-UHFFFAOYSA-N
XLogP3.41
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluorophenyl)-2-(furan-3-yl)-3-(4-methoxybenzoyl)-1,3-thiazolidine-4-carboxamide
CID 42745167
2-(furan-3-yl)-3-propanoyl-N-(pyridin-2-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 42744950
2-(furan-3-yl)-3-propanoyl-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazolidine-4-carboxamide
CID 42744948
2-(furan-3-yl)-3-propanoyl-N,N-dipropyl-1,3-thiazolidine-4-carboxamide
CID 42744933
3-acetyl-N-benzyl-2-(furan-3-yl)-1,3-thiazolidine-4-carboxamide
CID 42744957
2-(2-chlorophenyl)-N-(2-fluorophenyl)-3-(2-methylpropanoyl)-1,3-thiazolidine-4-carboxamide
CID 5217013
3-benzoyl-2-(furan-3-yl)-N-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide
CID 42745107
3-(2-chlorobenzoyl)-N-[(4-fluorophenyl)methyl]-2-(furan-3-yl)-1,3-thiazolidine-4-carboxamide
CID 42745200
(2S,4R)-3-(4-fluorobenzoyl)-2-(furan-3-yl)-N-hexyl-1,3-thiazolidine-4-carboxamide
CID 7419346
(2R,4R)-3-(2-chlorobenzoyl)-2-(furan-3-yl)-N-hexyl-1,3-thiazolidine-4-carboxamide
CID 7356695
3-acetyl-2-(furan-3-yl)-N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 42744974
2-(4-tert-butylphenyl)-N-(2-fluorophenyl)-3-(3,4,5-trimethoxybenzoyl)-1,3-thiazolidine-4-carboxamide
CID 3988039

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide (CID 42744943) is N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide is CCC(=O)N1C(C(=O)Nc2ccccc2F)CSC1c1ccoc1.
What is the InChIKey of N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide?
The InChIKey is NHDYTYQOHYXIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O3S/c1-2-15(21)20-14(10-24-17(20)11-7-8-23-9-11)16(22)19-13-6-4-3-5-12(13)18/h3-9,14,17H,2,10H2,1H3,(H,19,22).
What are the key properties of N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide?
N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide has a molecular weight of 348.40 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(furan-3-yl)-3-propanoyl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 42744943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).