(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide

C14H12F2N2OS2 — CID 816275

IUPAC(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)N1CCS[C@@H]1c1cccs1
InChIInChI=1S/C14H12F2N2OS2/c15-10-4-3-9(8-11(10)16)17-14(19)18-5-7-21-13(18)12-2-1-6-20-12/h1-4,6,8,13H,5,7H2,(H,17,19)/t13-/m1/s1
InChIKeyDPRPSFKWHRMMSK-CYBMUJFWSA-N
MW326.39 g/mol
LogP4.31
Rot. Bonds2

About (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide

(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide (PubChem CID 816275) has the molecular formula C14H12F2N2OS2 and a molecular weight of 326.39 g/mol. Its IUPAC name is (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide
PubChem CID816275
Molecular FormulaC14H12F2N2OS2
Molecular Weight326.39 g/mol
Exact Mass326.04
IUPAC Name(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)N1CCS[C@@H]1c1cccs1
InChIInChI=1S/C14H12F2N2OS2/c15-10-4-3-9(8-11(10)16)17-14(19)18-5-7-21-13(18)12-2-1-6-20-12/h1-4,6,8,13H,5,7H2,(H,17,19)/t13-/m1/s1
InChIKeyDPRPSFKWHRMMSK-CYBMUJFWSA-N
XLogP4.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.39
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-2-(4-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 4572857
(2S)-N-(3,4-difluorophenyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
CID 1028933
(2R)-N-(4-ethylphenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide
CID 816261
(2R)-N-(4-chlorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carbothioamide
CID 778002
N-(3,4-difluorophenyl)-2-(3-phenylmethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 4047301
N-(3-chloro-4-fluorophenyl)-2-thiophen-2-ylpyrrolidine-1-carboxamide
CID 20895936
(2R)-N-(3-fluoro-4-methylphenyl)-2-thiophen-2-ylpyrrolidine-1-carboxamide
CID 51550933
(2S)-N-(3-chloro-4-methylphenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7301691
N-(3-fluorophenyl)-2-(5-methylthiophen-2-yl)-1,3-thiazolidine-3-carboxamide
CID 3329326
(3-chlorophenyl)-[(2S)-2-thiophen-2-yl-1,3-thiazolidin-3-yl]methanone
CID 815506
(2R)-2-(2-fluorophenyl)-N-(4-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7499220
N-(3,4-difluorophenyl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)propanamide
CID 24506963

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide?
The IUPAC name of (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide (CID 816275) is (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide is O=C(Nc1ccc(F)c(F)c1)N1CCS[C@@H]1c1cccs1.
What is the InChIKey of (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide?
The InChIKey is DPRPSFKWHRMMSK-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H12F2N2OS2/c15-10-4-3-9(8-11(10)16)17-14(19)18-5-7-21-13(18)12-2-1-6-20-12/h1-4,6,8,13H,5,7H2,(H,17,19)/t13-/m1/s1.
What are the key properties of (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide?
(2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide has a molecular weight of 326.39 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3,4-difluorophenyl)-2-thiophen-2-yl-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 816275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).