N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C10H11ClF2N2OS — CID 119262947

IUPACN-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)cc1F)C1CSCN1
InChIInChI=1S/C10H10F2N2OS.ClH/c11-6-1-2-8(7(12)3-6)14-10(15)9-4-16-5-13-9;/h1-3,9,13H,4-5H2,(H,14,15);1H
InChIKeyUEIQVHFNFUBJNA-UHFFFAOYSA-N
MW280.73 g/mol
LogP1.99
Rot. Bonds2

About N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119262947) has the molecular formula C10H11ClF2N2OS and a molecular weight of 280.73 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119262947
Molecular FormulaC10H11ClF2N2OS
Molecular Weight280.73 g/mol
Exact Mass280.02
IUPAC NameN-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)cc1F)C1CSCN1
InChIInChI=1S/C10H10F2N2OS.ClH/c11-6-1-2-8(7(12)3-6)14-10(15)9-4-16-5-13-9;/h1-3,9,13H,4-5H2,(H,14,15);1H
InChIKeyUEIQVHFNFUBJNA-UHFFFAOYSA-N
XLogP1.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119262947) is N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(F)cc1F)C1CSCN1.
What is the InChIKey of N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is UEIQVHFNFUBJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2OS.ClH/c11-6-1-2-8(7(12)3-6)14-10(15)9-4-16-5-13-9;/h1-3,9,13H,4-5H2,(H,14,15);1H.
What are the key properties of N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 280.73 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119262947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).