N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide

C14H10N4O2S — CID 60700131

IUPACN-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2ccc3nccnc3c2)n1
InChIInChI=1S/C14H10N4O2S/c1-8(19)12-7-21-14(17-12)18-13(20)9-2-3-10-11(6-9)16-5-4-15-10/h2-7H,1H3,(H,17,18,20)
InChIKeyGCFZFEDIMYNRCT-UHFFFAOYSA-N
MW298.33 g/mol
LogP2.54
Rot. Bonds3

About N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide

N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide (PubChem CID 60700131) has the molecular formula C14H10N4O2S and a molecular weight of 298.33 g/mol. Its IUPAC name is N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
PubChem CID60700131
Molecular FormulaC14H10N4O2S
Molecular Weight298.33 g/mol
Exact Mass298.05
IUPAC NameN-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
SMILESCC(=O)c1csc(NC(=O)c2ccc3nccnc3c2)n1
InChIInChI=1S/C14H10N4O2S/c1-8(19)12-7-21-14(17-12)18-13(20)9-2-3-10-11(6-9)16-5-4-15-10/h2-7H,1H3,(H,17,18,20)
InChIKeyGCFZFEDIMYNRCT-UHFFFAOYSA-N
XLogP2.54
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-tert-butyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide
CID 2477287
N-(4-acetyl-1,3-thiazol-2-yl)-3-hydroxy-4-methylbenzamide
CID 64544456
N-(4-acetyl-1,3-thiazol-2-yl)-4-bromo-3-methylbenzamide
CID 112706110
N-(4-acetyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 60716919
N-[4-(2,5-dimethylthiophen-3-yl)-1,3-thiazol-2-yl]quinoxaline-6-carboxamide
CID 17449915
N-(4-acetyl-1,3-thiazol-2-yl)-4-propan-2-ylbenzamide
CID 24555772
N-(4-acetyl-1,3-thiazol-2-yl)-4-(difluoromethoxy)-3-methoxybenzamide
CID 26469303
N-(4-acetyl-1,3-thiazol-2-yl)-3-ethoxy-4-propoxybenzamide
CID 51248167
N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoxaline-6-carboxamide
CID 2449777
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-2-carboxamide
CID 26469458
N-(4-acetyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 78913584
4-(acetamidomethyl)-N-(4-acetyl-1,3-thiazol-2-yl)benzamide
CID 43033822

Frequently Asked Questions

What is the IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The IUPAC name of N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide (CID 60700131) is N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The canonical SMILES for N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide is CC(=O)c1csc(NC(=O)c2ccc3nccnc3c2)n1.
What is the InChIKey of N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
The InChIKey is GCFZFEDIMYNRCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2S/c1-8(19)12-7-21-14(17-12)18-13(20)9-2-3-10-11(6-9)16-5-4-15-10/h2-7H,1H3,(H,17,18,20).
What are the key properties of N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide?
N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide has a molecular weight of 298.33 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetyl-1,3-thiazol-2-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 60700131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).