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

C20H20N4O2 — CID 109284601

IUPAC5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cnc(Nc2ccccc2)cn1
InChIInChI=1S/C20H20N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-20(25)17-13-23-19(14-22-17)24-16-8-3-2-4-9-16/h2-10,13-14H,11-12H2,1H3,(H,21,25)(H,23,24)
InChIKeyDQGDITZIZIMEGT-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.20
Rot. Bonds7

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

5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide (PubChem CID 109284601) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide
PubChem CID109284601
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cnc(Nc2ccccc2)cn1
InChIInChI=1S/C20H20N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-20(25)17-13-23-19(14-22-17)24-16-8-3-2-4-9-16/h2-10,13-14H,11-12H2,1H3,(H,21,25)(H,23,24)
InChIKeyDQGDITZIZIMEGT-UHFFFAOYSA-N
XLogP3.20
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,5-dimethylanilino)-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide
CID 109284611
N-[2-(2-methoxyphenyl)ethyl]-5-methylpyrazine-2-carboxamide
CID 26181262
N-[2-(2-fluorophenyl)ethyl]-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109284290
N-[3-(dimethylamino)propyl]-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109277760
5-(4-chloroanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109192510
N-[2-(2-fluorophenyl)ethyl]-5-[(2-methoxyphenyl)methylamino]pyrazine-2-carboxamide
CID 109282286
5-(4-fluoroanilino)-N-[2-(2-fluorophenyl)ethyl]pyrazine-2-carboxamide
CID 109284281
N-[2-(2-methoxyphenyl)ethyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109158821
N-[2-(2-methoxyphenyl)ethyl]-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179678
5-[(2-methoxyphenyl)methylamino]-N-(3-phenylpropyl)pyrazine-2-carboxamide
CID 109282298
5-anilino-N-[2-(dimethylamino)ethyl]pyrazine-2-carboxamide
CID 109277171
5-(2-fluoroanilino)-N-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109282232

Frequently Asked Questions

What is the IUPAC name of 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The IUPAC name of 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide (CID 109284601) is 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide is COc1ccccc1CCNC(=O)c1cnc(Nc2ccccc2)cn1.
What is the InChIKey of 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
The InChIKey is DQGDITZIZIMEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-26-18-10-6-5-7-15(18)11-12-21-20(25)17-13-23-19(14-22-17)24-16-8-3-2-4-9-16/h2-10,13-14H,11-12H2,1H3,(H,21,25)(H,23,24).
What are the key properties of 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide?
5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-anilino-N-[2-(2-methoxyphenyl)ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 109284601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).