N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide

C17H17N3OS — CID 51205761

IUPACN,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)N(C)Cc3cccs3)cc2nc1C
InChIInChI=1S/C17H17N3OS/c1-11-12(2)19-16-9-13(6-7-15(16)18-11)17(21)20(3)10-14-5-4-8-22-14/h4-9H,10H2,1-3H3
InChIKeyFXIJEQWAKPTGKH-UHFFFAOYSA-N
MW311.41 g/mol
LogP3.58
Rot. Bonds3

About N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide

N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide (PubChem CID 51205761) has the molecular formula C17H17N3OS and a molecular weight of 311.41 g/mol. Its IUPAC name is N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
PubChem CID51205761
Molecular FormulaC17H17N3OS
Molecular Weight311.41 g/mol
Exact Mass311.11
IUPAC NameN,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)N(C)Cc3cccs3)cc2nc1C
InChIInChI=1S/C17H17N3OS/c1-11-12(2)19-16-9-13(6-7-15(16)18-11)17(21)20(3)10-14-5-4-8-22-14/h4-9H,10H2,1-3H3
InChIKeyFXIJEQWAKPTGKH-UHFFFAOYSA-N
XLogP3.58
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-chlorophenyl)methyl]-N,2,3-trimethylquinoxaline-6-carboxamide
CID 39966358
3-amino-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527201
[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate
CID 8959157
2-amino-6-chloro-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62154274
N,3,6-trimethyl-N-(thiophen-2-ylmethyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 18162206
2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 55047494
3-hydroxy-N-methyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide
CID 18114264
N-methyl-2-oxo-N-(thiophen-2-ylmethyl)-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18103126
3,5-diacetamido-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 17429130
2-(dimethylamino)-N,6-dimethyl-N-(thiophen-2-ylmethyl)pyrimidine-4-carboxamide
CID 71689290
3-chloro-N-methyl-4-nitro-N-(thiophen-2-ylmethyl)benzamide
CID 82781483
N,2,3-trimethyl-N-[[2-(morpholin-4-ylmethyl)-1,3-thiazol-4-yl]methyl]quinoxaline-6-carboxamide
CID 108768975

Frequently Asked Questions

What is the IUPAC name of N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide?
The IUPAC name of N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide (CID 51205761) is N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide.
What is the SMILES notation for N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide?
The canonical SMILES for N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide is Cc1nc2ccc(C(=O)N(C)Cc3cccs3)cc2nc1C.
What is the InChIKey of N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide?
The InChIKey is FXIJEQWAKPTGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3OS/c1-11-12(2)19-16-9-13(6-7-15(16)18-11)17(21)20(3)10-14-5-4-8-22-14/h4-9H,10H2,1-3H3.
What are the key properties of N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide?
N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide has a molecular weight of 311.41 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide is sourced from PubChem (CID 51205761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).