2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide

C21H18N4O — CID 29152059

IUPAC2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide
SMILESCc1cc(NC(=O)c2ccc3nc(C)c(C)nc3c2)c2ccccc2n1
InChIInChI=1S/C21H18N4O/c1-12-10-19(16-6-4-5-7-17(16)22-12)25-21(26)15-8-9-18-20(11-15)24-14(3)13(2)23-18/h4-11H,1-3H3,(H,22,25,26)
InChIKeyLJNSJXCHUPWOGK-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.36
Rot. Bonds2

About 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide

2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide (PubChem CID 29152059) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide
PubChem CID29152059
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide
SMILESCc1cc(NC(=O)c2ccc3nc(C)c(C)nc3c2)c2ccccc2n1
InChIInChI=1S/C21H18N4O/c1-12-10-19(16-6-4-5-7-17(16)22-12)25-21(26)15-8-9-18-20(11-15)24-14(3)13(2)23-18/h4-11H,1-3H3,(H,22,25,26)
InChIKeyLJNSJXCHUPWOGK-UHFFFAOYSA-N
XLogP4.36
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(2-methylquinolin-4-yl)benzamide
CID 4298030
N-(2-methylquinolin-4-yl)-3-sulfanylbenzamide
CID 107020202
2,3-dimethyl-N-quinolin-5-ylquinoxaline-6-carboxamide
CID 51205597
2-methyl-N-(2-methylquinolin-4-yl)benzamide
CID 3291896
2-iodo-N-(2-methylquinolin-4-yl)benzamide
CID 60653788
1-(2-methylquinolin-4-yl)-3-phenylurea
CID 5110969
4-bromo-N-(2-methylquinolin-4-yl)-1H-pyrrole-2-carboxamide
CID 43411205
N-(3-benzamidophenazin-2-yl)benzamide
CID 3547793
(E)-N-(2-methylquinolin-4-yl)-3-phenylprop-2-enamide
CID 1124742
3-iodo-N-(2-methylquinolin-5-yl)benzamide
CID 17099145
3-amino-N-(2-methylquinolin-4-yl)pyridine-2-carboxamide
CID 104740834
3-[(2-methylquinolin-4-yl)amino]benzoic acid
CID 43419955

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide?
The IUPAC name of 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide (CID 29152059) is 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide?
The canonical SMILES for 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide is Cc1cc(NC(=O)c2ccc3nc(C)c(C)nc3c2)c2ccccc2n1.
What is the InChIKey of 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide?
The InChIKey is LJNSJXCHUPWOGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-12-10-19(16-6-4-5-7-17(16)22-12)25-21(26)15-8-9-18-20(11-15)24-14(3)13(2)23-18/h4-11H,1-3H3,(H,22,25,26).
What are the key properties of 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide?
2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2-methylquinolin-4-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 29152059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).