N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide

C20H20N4O3 — CID 109293614

IUPACN-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cnc(Nc3ccc(OC)cc3)cn2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-27-17-10-6-15(7-11-17)24-20(25)18-12-22-19(13-21-18)23-14-4-8-16(26-2)9-5-14/h4-13H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyANGCEGODGBWXDX-UHFFFAOYSA-N
MW364.41 g/mol
LogP3.88
Rot. Bonds7

About N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide

N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide (PubChem CID 109293614) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
PubChem CID109293614
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cnc(Nc3ccc(OC)cc3)cn2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-27-17-10-6-15(7-11-17)24-20(25)18-12-22-19(13-21-18)23-14-4-8-16(26-2)9-5-14/h4-13H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyANGCEGODGBWXDX-UHFFFAOYSA-N
XLogP3.88
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-ethoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289463
N-[4-(dimethylamino)phenyl]-5-(4-ethoxyanilino)pyrazine-2-carboxamide
CID 109293760
methyl 4-[[5-(4-methoxyanilino)pyrazine-2-carbonyl]amino]benzoate
CID 109293630
5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293597
6-(4-ethoxyanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109129382
6-(4-ethoxyanilino)-N-(4-methoxyphenyl)pyrimidine-4-carboxamide
CID 109358931
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
5-(3-chloro-4-methylanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293161
5-(3-chloro-4-methoxyanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293298
5-(2,3-dimethylanilino)-N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 109291428
5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293748
5-(4-methoxyanilino)-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282451

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide (CID 109293614) is N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide is CCOc1ccc(NC(=O)c2cnc(Nc3ccc(OC)cc3)cn2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide?
The InChIKey is ANGCEGODGBWXDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-3-27-17-10-6-15(7-11-17)24-20(25)18-12-22-19(13-21-18)23-14-4-8-16(26-2)9-5-14/h4-13H,3H2,1-2H3,(H,22,23)(H,24,25).
What are the key properties of N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide?
N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide has a molecular weight of 364.41 g/mol, XLogP of 3.88, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109293614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).