1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one

C21H23N3O2 — CID 142097212

IUPAC1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one
SMILESCCn1c(-c2ccc(OC)cc2)cnc(NCCc2ccccc2)c1=O
InChIInChI=1S/C21H23N3O2/c1-3-24-19(17-9-11-18(26-2)12-10-17)15-23-20(21(24)25)22-14-13-16-7-5-4-6-8-16/h4-12,15H,3,13-14H2,1-2H3,(H,22,23)
InChIKeyBXQYDOGOSYHGAT-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.59
Rot. Bonds7

About 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one

1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one (PubChem CID 142097212) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one
PubChem CID142097212
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one
SMILESCCn1c(-c2ccc(OC)cc2)cnc(NCCc2ccccc2)c1=O
InChIInChI=1S/C21H23N3O2/c1-3-24-19(17-9-11-18(26-2)12-10-17)15-23-20(21(24)25)22-14-13-16-7-5-4-6-8-16/h4-12,15H,3,13-14H2,1-2H3,(H,22,23)
InChIKeyBXQYDOGOSYHGAT-UHFFFAOYSA-N
XLogP3.59
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[6-(3-ethylphenyl)-2-oxo-3-(2-phenylethylamino)pyrazin-1-yl]acetic acid
CID 157270560
1-ethyl-5-(4-methoxyphenyl)-N-(2-phenylethyl)pyrazole-3-carboxamide
CID 46104554
N-[3-(diaminomethylideneamino)propyl]-2-[2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-yl]acetamide;trihydrochloride
CID 162320818
2-N,3-N-bis[2-(4-methoxyphenyl)ethyl]quinoxaline-2,3-diamine
CID 1023772
2-[3-[(2,4-dimethoxyphenyl)methylamino]-2-oxo-6-phenylpyrazin-1-yl]acetic acid
CID 170790056
N-[1-ethyl-2-(4-methoxyphenyl)-6-oxopyrimidin-5-yl]benzamide
CID 142150656
[(1-methylpyrrolo[3,2-c]pyridin-2-yl)methyl-[2-[2-oxo-6-phenyl-3-(2-phenylethylamino)pyrazin-1-yl]acetyl]amino] 2,2,2-trifluoroacetate
CID 167431220
3-[2-(3-methoxyphenyl)ethylamino]-1-methylpyrazin-2-one
CID 103702647
2-[6-(3-ethylphenyl)-2-oxo-3-(2-phenylethylamino)pyrazin-1-yl]acetic acid;2-[6-(3-ethylphenyl)-2-oxo-3-(2-phenylethylamino)pyrazin-1-yl]-N-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)acetamide;1H-pyrrolo[3,2-c]pyridin-2-ylmethanamine
CID 159752401
2-[6-[(E)-4-hydroxybut-1-enyl]-2-oxo-3-(2-phenylethylamino)pyrazin-1-yl]acetic acid
CID 156750867
methyl 2-[6-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(2-phenylethylamino)phenyl]-2-oxo-3-(propan-2-ylamino)pyrazin-1-yl]acetate
CID 86592722
2-(4-methoxyphenyl)-5-(4-phenylbutyl)pyrimidine
CID 23361560

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one?
The IUPAC name of 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one (CID 142097212) is 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one.
What is the SMILES notation for 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one?
The canonical SMILES for 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one is CCn1c(-c2ccc(OC)cc2)cnc(NCCc2ccccc2)c1=O.
What is the InChIKey of 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one?
The InChIKey is BXQYDOGOSYHGAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-3-24-19(17-9-11-18(26-2)12-10-17)15-23-20(21(24)25)22-14-13-16-7-5-4-6-8-16/h4-12,15H,3,13-14H2,1-2H3,(H,22,23).
What are the key properties of 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one?
1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one has a molecular weight of 349.43 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-(4-methoxyphenyl)-3-(2-phenylethylamino)pyrazin-2-one is sourced from PubChem (CID 142097212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).