5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide

C20H20N4O2 — CID 109290242

IUPAC5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
SMILESCCOc1ccccc1Nc1cnc(C(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C20H20N4O2/c1-3-26-18-12-8-7-11-16(18)23-19-14-21-17(13-22-19)20(25)24(2)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23)
InChIKeyDHODWKRUIRZATH-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.90
Rot. Bonds6

About 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide

5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide (PubChem CID 109290242) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
PubChem CID109290242
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
SMILESCCOc1ccccc1Nc1cnc(C(=O)N(C)c2ccccc2)cn1
InChIInChI=1S/C20H20N4O2/c1-3-26-18-12-8-7-11-16(18)23-19-14-21-17(13-22-19)20(25)24(2)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23)
InChIKeyDHODWKRUIRZATH-UHFFFAOYSA-N
XLogP3.90
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197592
5-(2-ethoxyanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286788
5-(2-chloroanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
CID 109290226
5-(2-ethoxyanilino)-N-(3-phenylpropyl)pyrazine-2-carboxamide
CID 109287022
5-[4-(diethylamino)anilino]-N-methyl-N-phenylpyrazine-2-carboxamide
CID 109290262
N-methyl-N-phenyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271049
N-(2-tert-butylphenyl)-5-(2-ethoxyanilino)pyrazine-2-carboxamide
CID 109292240
5-(2,6-dimethylanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
CID 109290211
5-(2-ethoxyanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290053
5-(2-ethoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291933
methyl 4-[[5-[methyl(phenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109290259
N-methyl-5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-phenylpyrazine-2-carboxamide
CID 109290299

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The IUPAC name of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide (CID 109290242) is 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The canonical SMILES for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide is CCOc1ccccc1Nc1cnc(C(=O)N(C)c2ccccc2)cn1.
What is the InChIKey of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide?
The InChIKey is DHODWKRUIRZATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-3-26-18-12-8-7-11-16(18)23-19-14-21-17(13-22-19)20(25)24(2)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23).
What are the key properties of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide?
5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide is sourced from PubChem (CID 109290242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).