2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide

C21H18N4O2 — CID 110618929

IUPAC2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)Nc3ccc4cc(C)c(=O)[nH]c4c3)cc2nc1C
InChIInChI=1S/C21H18N4O2/c1-11-8-14-4-6-16(10-18(14)25-20(11)26)24-21(27)15-5-7-17-19(9-15)23-13(3)12(2)22-17/h4-10H,1-3H3,(H,24,27)(H,25,26)
InChIKeyCFDVTRCCCRWQAB-UHFFFAOYSA-N
MW358.40 g/mol
LogP3.65
Rot. Bonds2

About 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide

2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide (PubChem CID 110618929) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide
PubChem CID110618929
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Name2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)Nc3ccc4cc(C)c(=O)[nH]c4c3)cc2nc1C
InChIInChI=1S/C21H18N4O2/c1-11-8-14-4-6-16(10-18(14)25-20(11)26)24-21(27)15-5-7-17-19(9-15)23-13(3)12(2)22-17/h4-10H,1-3H3,(H,24,27)(H,25,26)
InChIKeyCFDVTRCCCRWQAB-UHFFFAOYSA-N
XLogP3.65
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)benzamide
CID 110427940
3,4-difluoro-N-(3-methyl-2-oxo-1H-quinolin-7-yl)benzamide
CID 110427991
3-fluoro-N-(3-methyl-2-oxo-1H-quinolin-7-yl)benzamide
CID 110604374
3-chloro-N-(3-methyl-2-oxo-1H-quinolin-7-yl)benzamide
CID 110604388
N-(3-methyl-2-oxo-1H-quinolin-7-yl)propanamide
CID 110427931
N-(3-methyl-2-oxo-1H-quinolin-7-yl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 110668240
N-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 110669843
2,3-dimethyl-N-(5-methyl-3-pyridinyl)quinoxaline-6-carboxamide
CID 110744358
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2,3-dimethylquinoxaline-6-carboxamide
CID 46563844
N-(3-acetamido-4-methoxyphenyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 46543736
5-fluoro-2-methyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)-1H-indole-3-carboxamide
CID 110613684
N-(3-methyl-2-oxo-1H-quinolin-7-yl)oxolane-2-carboxamide
CID 110604367

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide?
The IUPAC name of 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide (CID 110618929) is 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide?
The canonical SMILES for 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide is Cc1nc2ccc(C(=O)Nc3ccc4cc(C)c(=O)[nH]c4c3)cc2nc1C.
What is the InChIKey of 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide?
The InChIKey is CFDVTRCCCRWQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c1-11-8-14-4-6-16(10-18(14)25-20(11)26)24-21(27)15-5-7-17-19(9-15)23-13(3)12(2)22-17/h4-10H,1-3H3,(H,24,27)(H,25,26).
What are the key properties of 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide?
2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 3.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(3-methyl-2-oxo-1H-quinolin-7-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 110618929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).