N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide

C19H18N4O2 — CID 131923245

IUPACN-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
SMILESCc1c(NC(=O)c2cnc3ccccc3n2)cccc1C(=O)N(C)C
InChIInChI=1S/C19H18N4O2/c1-12-13(19(25)23(2)3)7-6-10-14(12)22-18(24)17-11-20-15-8-4-5-9-16(15)21-17/h4-11H,1-3H3,(H,22,24)
InChIKeyHLZODLIYDHZSMO-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.89
Rot. Bonds3

About N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide

N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide (PubChem CID 131923245) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
PubChem CID131923245
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide
SMILESCc1c(NC(=O)c2cnc3ccccc3n2)cccc1C(=O)N(C)C
InChIInChI=1S/C19H18N4O2/c1-12-13(19(25)23(2)3)7-6-10-14(12)22-18(24)17-11-20-15-8-4-5-9-16(15)21-17/h4-11H,1-3H3,(H,22,24)
InChIKeyHLZODLIYDHZSMO-UHFFFAOYSA-N
XLogP2.89
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-3-nitrophenyl)quinoxaline-2-carboxamide
CID 17420585
N-[3-(dimethylcarbamoyl)-2-methylphenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 131897206
N-(2-bromophenyl)quinoxaline-2-carboxamide
CID 17429565
N-[2-(dimethylamino)pyrimidin-5-yl]quinoxaline-2-carboxamide
CID 122297962
N-[3-(dimethylcarbamoyl)-2-methylphenyl]-6-methoxypyridine-3-carboxamide
CID 131900046
N-[5-[[2-(dimethylamino)acetyl]amino]-2-methylphenyl]quinoxaline-2-carboxamide
CID 131912464
N-[2-(piperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
CID 17420584
N-(2-methyl-5-methylsulfonylphenyl)quinoxaline-2-carboxamide
CID 27990943
N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]quinoxaline-2-carboxamide
CID 55676948
N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
CID 95763379
N-(4-chloro-2,5-dimethoxyphenyl)quinoxaline-2-carboxamide
CID 17433781
N-[(2-methylphenyl)methyl]quinoxaline-2-carboxamide
CID 17418457

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide?
The IUPAC name of N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide (CID 131923245) is N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide?
The canonical SMILES for N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide is Cc1c(NC(=O)c2cnc3ccccc3n2)cccc1C(=O)N(C)C.
What is the InChIKey of N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide?
The InChIKey is HLZODLIYDHZSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-12-13(19(25)23(2)3)7-6-10-14(12)22-18(24)17-11-20-15-8-4-5-9-16(15)21-17/h4-11H,1-3H3,(H,22,24).
What are the key properties of N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide?
N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylcarbamoyl)-2-methylphenyl]quinoxaline-2-carboxamide is sourced from PubChem (CID 131923245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).