1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one

C17H22N4O2 — CID 126825731

IUPAC1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one
SMILESCn1ccnc(NCCc2ccccc2N2CCOCC2)c1=O
InChIInChI=1S/C17H22N4O2/c1-20-9-8-19-16(17(20)22)18-7-6-14-4-2-3-5-15(14)21-10-12-23-13-11-21/h2-5,8-9H,6-7,10-13H2,1H3,(H,18,19)
InChIKeyDNBAFYMYMPXUSG-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.27
Rot. Bonds5

About 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one

1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one (PubChem CID 126825731) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one.

Molecular Properties

Compound Name1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one
PubChem CID126825731
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one
SMILESCn1ccnc(NCCc2ccccc2N2CCOCC2)c1=O
InChIInChI=1S/C17H22N4O2/c1-20-9-8-19-16(17(20)22)18-7-6-14-4-2-3-5-15(14)21-10-12-23-13-11-21/h2-5,8-9H,6-7,10-13H2,1H3,(H,18,19)
InChIKeyDNBAFYMYMPXUSG-UHFFFAOYSA-N
XLogP1.27
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,4-dimethylphenyl)-N'-[3-(morpholin-4-yl)propyl]ethanediamide
CID 1912438
4-Morpholineacetamide, N-(2-methylphenyl)-, monohydrochloride
CID 2827840
5-Chloro-1-[2-methoxy-1-(methoxymethyl)ethyl]-3-(2,4,6-trimethylphenylamino)pyrazin-2(1H)-one
CID 15485774
7-Methyl-9-(2-methylanilino)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 57798309
7-Methyl-9-[1-(3-methylanilino)ethyl]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839834
N-(2-methylphenyl)-2-[4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetamide
CID 136230227
N-Biphenyl-2-yl-2-morpholin-4-yl-acetamide
CID 653343
3-(2-morpholin-4-ylethylamino)-1H-quinoxalin-2-one
CID 665072
N'-(2,6-dimethylphenyl)-N-(3-morpholin-4-ylpropyl)oxamide
CID 2291523
2-[4-Methyl-2-oxopyrimido[1,2-B]indazol-6(2H)-YL]-N-(3-morpholinopropyl)acetamide
CID 3249111
2-{4-Methyl-2-oxo-2H,6H-pyrimido[1,2-B]indazol-6-YL}-N-[3-(morpholin-4-YL)propyl]butanamide
CID 22511505
2-(4-methyl-2-oxo-6-pyrimido[1,2-b]indazolyl)-N-[2-(4-morpholinyl)ethyl]butanamide
CID 22511532

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one?
The IUPAC name of 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one (CID 126825731) is 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one.
What is the SMILES notation for 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one?
The canonical SMILES for 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one is Cn1ccnc(NCCc2ccccc2N2CCOCC2)c1=O.
What is the InChIKey of 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one?
The InChIKey is DNBAFYMYMPXUSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-20-9-8-19-16(17(20)22)18-7-6-14-4-2-3-5-15(14)21-10-12-23-13-11-21/h2-5,8-9H,6-7,10-13H2,1H3,(H,18,19).
What are the key properties of 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one?
1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one has a molecular weight of 314.39 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[2-(2-morpholin-4-ylphenyl)ethylamino]pyrazin-2-one is sourced from PubChem (CID 126825731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).