5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide

C22H24N4O2 — CID 109284871

IUPAC5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCCc1ccc(Nc2cnc(C(=O)NCCc3ccc(OC)cc3)cn2)cc1
InChIInChI=1S/C22H24N4O2/c1-3-16-4-8-18(9-5-16)26-21-15-24-20(14-25-21)22(27)23-13-12-17-6-10-19(28-2)11-7-17/h4-11,14-15H,3,12-13H2,1-2H3,(H,23,27)(H,25,26)
InChIKeyIMIBNOIVLGFPEM-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.76
Rot. Bonds8

About 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide

5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide (PubChem CID 109284871) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
PubChem CID109284871
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCCc1ccc(Nc2cnc(C(=O)NCCc3ccc(OC)cc3)cn2)cc1
InChIInChI=1S/C22H24N4O2/c1-3-16-4-8-18(9-5-16)26-21-15-24-20(14-25-21)22(27)23-13-12-17-6-10-19(28-2)11-7-17/h4-11,14-15H,3,12-13H2,1-2H3,(H,23,27)(H,25,26)
InChIKeyIMIBNOIVLGFPEM-UHFFFAOYSA-N
XLogP3.76
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
CID 109284888
5-(4-methoxyanilino)-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282451
N-[2-(4-methoxyphenyl)ethyl]-5-(propylamino)pyrazine-2-carboxamide
CID 109271001
N-[2-(4-methoxyphenyl)ethyl]-5-(propan-2-ylamino)pyrazine-2-carboxamide
CID 109271398
N-[3-(dimethylamino)propyl]-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109277841
5-(2,5-dimethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
CID 109284865
N-[2-(4-fluorophenyl)ethyl]-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109284467
N-[2-(4-fluorophenyl)ethyl]-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109192362
N-[2-(4-methoxyphenyl)ethyl]-5-(pyridin-4-ylmethylamino)pyrazine-2-carboxamide
CID 109283647
5-(4-acetamidoanilino)-N-[2-(4-fluorophenyl)ethyl]pyrazine-2-carboxamide
CID 109284480
N-[2-(3-methoxyphenyl)ethyl]-5-(4-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109284747
5-(4-acetylanilino)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
CID 109285808

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide (CID 109284871) is 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide is CCc1ccc(Nc2cnc(C(=O)NCCc3ccc(OC)cc3)cn2)cc1.
What is the InChIKey of 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The InChIKey is IMIBNOIVLGFPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-3-16-4-8-18(9-5-16)26-21-15-24-20(14-25-21)22(27)23-13-12-17-6-10-19(28-2)11-7-17/h4-11,14-15H,3,12-13H2,1-2H3,(H,23,27)(H,25,26).
What are the key properties of 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.76, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 109284871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).