N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide

C15H17FN2O2S — CID 71956514

IUPACN-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
SMILESO=C(CCN1C(=O)CSC1c1ccccc1F)NC1CC1
InChIInChI=1S/C15H17FN2O2S/c16-12-4-2-1-3-11(12)15-18(14(20)9-21-15)8-7-13(19)17-10-5-6-10/h1-4,10,15H,5-9H2,(H,17,19)
InChIKeyDULYYAACANQTFL-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.07
Rot. Bonds5

About N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide

N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide (PubChem CID 71956514) has the molecular formula C15H17FN2O2S and a molecular weight of 308.38 g/mol. Its IUPAC name is N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
PubChem CID71956514
Molecular FormulaC15H17FN2O2S
Molecular Weight308.38 g/mol
Exact Mass308.10
IUPAC NameN-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
SMILESO=C(CCN1C(=O)CSC1c1ccccc1F)NC1CC1
InChIInChI=1S/C15H17FN2O2S/c16-12-4-2-1-3-11(12)15-18(14(20)9-21-15)8-7-13(19)17-10-5-6-10/h1-4,10,15H,5-9H2,(H,17,19)
InChIKeyDULYYAACANQTFL-UHFFFAOYSA-N
XLogP2.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Fluorophenyl)-1,3-thiazolan-4-one
CID 2732088
3-[(2-fluorobenzyl)thio]-N-(1-phenylethyl)propanamide
CID 5053724
(4R)-N-Octadecyl-2-phenyl-4-thiazolidinecarboxamide
CID 11156218
(4R)-2-phenyl-N-tetradecyl-1,3-thiazolidine-4-carboxamide
CID 11316635
H-bAla(3R-Bn(2,4,5-triF))-DL-2Thz-NHBn.HCl
CID 25056092
(R)-3-Amino-4-(2-fluoro-phenyl)-1-thiazolidin-3-yl-butan-1-one
CID 44394238
Atcaa-1
CID 44433149
2-Phenyl-1,3-thiazolidin-4-one
CID 290165
3-[3-(Dimethylamino)propyl]-2-(4-fluorophenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 2872049
5-Oxo-tetrahydro-thiophene-3-carboxylic acid cyclohexylcarbamoylmethyl-(4-fluoro-benzyl)-amide
CID 3219503
(R)-3-Amino-4-(2,4-difluoro-phenyl)-1-thiazolidin-3-yl-butan-1-one
CID 44394024
(R)-3-amino-4-(2,5-difluorophenyl)-1-(thiazolidin-3-yl)butan-1-one
CID 44394103

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The IUPAC name of N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide (CID 71956514) is N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The canonical SMILES for N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide is O=C(CCN1C(=O)CSC1c1ccccc1F)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
The InChIKey is DULYYAACANQTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O2S/c16-12-4-2-1-3-11(12)15-18(14(20)9-21-15)8-7-13(19)17-10-5-6-10/h1-4,10,15H,5-9H2,(H,17,19).
What are the key properties of N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide?
N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide has a molecular weight of 308.38 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[2-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide is sourced from PubChem (CID 71956514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).