5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide

C20H20N4O — CID 109283821

IUPAC5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide
SMILESCN(c1ccccc1)c1cnc(C(=O)NCCc2ccccc2)cn1
InChIInChI=1S/C20H20N4O/c1-24(17-10-6-3-7-11-17)19-15-22-18(14-23-19)20(25)21-13-12-16-8-4-2-5-9-16/h2-11,14-15H,12-13H2,1H3,(H,21,25)
InChIKeyUYMDFBYDUDUFGN-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.22
Rot. Bonds6

About 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide

5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide (PubChem CID 109283821) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide
PubChem CID109283821
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC Name5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide
SMILESCN(c1ccccc1)c1cnc(C(=O)NCCc2ccccc2)cn1
InChIInChI=1S/C20H20N4O/c1-24(17-10-6-3-7-11-17)19-15-22-18(14-23-19)20(25)21-13-12-16-8-4-2-5-9-16/h2-11,14-15H,12-13H2,1H3,(H,21,25)
InChIKeyUYMDFBYDUDUFGN-UHFFFAOYSA-N
XLogP3.22
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109285784
N-[2-(1H-indol-3-yl)ethyl]-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109285636
5-(N-ethyl-3-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide
CID 109283898
5-(N-methylanilino)-N-phenylpyrazine-2-carboxamide
CID 109289424
5-[benzyl(methyl)amino]-N-[2-(dimethylamino)ethyl]pyrazine-2-carboxamide
CID 109277110
5-[benzyl(ethyl)amino]-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
CID 109282839
N-[2-(4-chlorophenyl)ethyl]-6-(N-methylanilino)pyridazine-3-carboxamide
CID 109123397
N-[2-(4-methoxyphenyl)ethyl]-6-(N-methylanilino)pyrimidine-4-carboxamide
CID 109351495
5-(N-methylanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235813
N-[4-(diethylamino)phenyl]-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109290357
N-[2-(3-methoxyphenyl)ethyl]-6-(N-methylanilino)pyrimidine-4-carboxamide
CID 109351369
N-[2-(4-chlorophenyl)ethyl]-5-(diethylamino)pyrazine-2-carboxamide
CID 109285769

Frequently Asked Questions

What is the IUPAC name of 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide (CID 109283821) is 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide is CN(c1ccccc1)c1cnc(C(=O)NCCc2ccccc2)cn1.
What is the InChIKey of 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide?
The InChIKey is UYMDFBYDUDUFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-24(17-10-6-3-7-11-17)19-15-22-18(14-23-19)20(25)21-13-12-16-8-4-2-5-9-16/h2-11,14-15H,12-13H2,1H3,(H,21,25).
What are the key properties of 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide?
5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide has a molecular weight of 332.41 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N-methylanilino)-N-(2-phenylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109283821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).