N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide

C23H26N4O — CID 109282777

IUPACN-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cnc(Nc2c(C)cc(C)cc2C)cn1
InChIInChI=1S/C23H26N4O/c1-5-27(15-19-9-7-6-8-10-19)23(28)20-13-25-21(14-24-20)26-22-17(3)11-16(2)12-18(22)4/h6-14H,5,15H2,1-4H3,(H,25,26)
InChIKeyREOYSFZVHXWMSA-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.81
Rot. Bonds6

About N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide

N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide (PubChem CID 109282777) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide
PubChem CID109282777
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC NameN-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)c1cnc(Nc2c(C)cc(C)cc2C)cn1
InChIInChI=1S/C23H26N4O/c1-5-27(15-19-9-7-6-8-10-19)23(28)20-13-25-21(14-24-20)26-22-17(3)11-16(2)12-18(22)4/h6-14H,5,15H2,1-4H3,(H,25,26)
InChIKeyREOYSFZVHXWMSA-UHFFFAOYSA-N
XLogP4.81
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-5-(2,6-dimethylanilino)-N-methylpyrazine-2-carboxamide
CID 109281079
N-benzyl-5-(butylamino)-N-ethylpyrazine-2-carboxamide
CID 109272566
methyl 3-[[5-[benzyl(ethyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109282808
N-benzyl-N-ethyl-5-(4-propan-2-yloxyanilino)pyrazine-2-carboxamide
CID 109282799
N-benzyl-5-(3-chloro-4-methoxyanilino)-N-ethylpyrazine-2-carboxamide
CID 109282790
N-[(2-methylphenyl)methyl]-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide
CID 109280021
5-(2,6-dichloroanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286839
N-benzyl-6-(3,4-dimethylanilino)-N-ethylpyrimidine-4-carboxamide
CID 109349509
N-benzyl-N-methyl-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109281071
N-benzyl-N-methyl-5-(3-methylanilino)pyrazine-2-carboxamide
CID 109281070
N-benzyl-N-ethyl-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-2-carboxamide
CID 109190788
N-benzyl-N-ethyl-6-[(2-methylphenyl)methylamino]pyrimidine-4-carboxamide
CID 109346785

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide (CID 109282777) is N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide is CCN(Cc1ccccc1)C(=O)c1cnc(Nc2c(C)cc(C)cc2C)cn1.
What is the InChIKey of N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide?
The InChIKey is REOYSFZVHXWMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-5-27(15-19-9-7-6-8-10-19)23(28)20-13-25-21(14-24-20)26-22-17(3)11-16(2)12-18(22)4/h6-14H,5,15H2,1-4H3,(H,25,26).
What are the key properties of N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide?
N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide has a molecular weight of 374.49 g/mol, XLogP of 4.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-5-(2,4,6-trimethylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109282777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).