N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide

C12H12N4OS — CID 54862020

IUPACN-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc2nccnc2c1)C1CSCN1
InChIInChI=1S/C12H12N4OS/c17-12(11-6-18-7-15-11)16-8-1-2-9-10(5-8)14-4-3-13-9/h1-5,11,15H,6-7H2,(H,16,17)
InChIKeyVSJVINMAFGARCN-UHFFFAOYSA-N
MW260.32 g/mol
LogP1.23
Rot. Bonds2

About N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide

N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide (PubChem CID 54862020) has the molecular formula C12H12N4OS and a molecular weight of 260.32 g/mol. Its IUPAC name is N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
PubChem CID54862020
Molecular FormulaC12H12N4OS
Molecular Weight260.32 g/mol
Exact Mass260.07
IUPAC NameN-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc2nccnc2c1)C1CSCN1
InChIInChI=1S/C12H12N4OS/c17-12(11-6-18-7-15-11)16-8-1-2-9-10(5-8)14-4-3-13-9/h1-5,11,15H,6-7H2,(H,16,17)
InChIKeyVSJVINMAFGARCN-UHFFFAOYSA-N
XLogP1.23
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
CID 24692510
N-quinoxalin-6-ylpiperidine-2-carboxamide
CID 54862032
N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119832878
N-(2-methyl-1,3-benzothiazol-6-yl)-1,3-thiazolidine-4-carboxamide
CID 43702559
4-methyl-N-quinoxalin-6-ylpiperidine-2-carboxamide
CID 114423238
N-(3,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 50988129
N-(3,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119263074
N-[4-[6-(1,3-thiazolidine-4-carbonylamino)-1H-benzimidazol-2-yl]phenyl]-1,3-thiazolidine-4-carboxamide
CID 10310566
N-(2-cyclopropyl-1,3-benzothiazol-6-yl)-1,3-thiazolidine-4-carboxamide
CID 119306490
N-(6-bromo-3-pyridinyl)-1,3-thiazolidine-4-carboxamide
CID 110672131
N-(2,3-dihydro-1H-inden-5-yl)-1,3-thiazolidine-4-carboxamide
CID 24706047
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazolidine-4-carboxamide
CID 24698635

Frequently Asked Questions

What is the IUPAC name of N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide (CID 54862020) is N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide is O=C(Nc1ccc2nccnc2c1)C1CSCN1.
What is the InChIKey of N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide?
The InChIKey is VSJVINMAFGARCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4OS/c17-12(11-6-18-7-15-11)16-8-1-2-9-10(5-8)14-4-3-13-9/h1-5,11,15H,6-7H2,(H,16,17).
What are the key properties of N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide?
N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide has a molecular weight of 260.32 g/mol, XLogP of 1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 54862020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).