1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one

C16H21N5O2 — CID 146125355

IUPAC1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one
SMILESCCn1ccnc(N2CCN(c3cc(OC)ccn3)CC2)c1=O
InChIInChI=1S/C16H21N5O2/c1-3-19-7-6-18-15(16(19)22)21-10-8-20(9-11-21)14-12-13(23-2)4-5-17-14/h4-7,12H,3,8-11H2,1-2H3
InChIKeyVPJDXZXMCISKAG-UHFFFAOYSA-N
MW315.38 g/mol
LogP0.99
Rot. Bonds4

About 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one

1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one (PubChem CID 146125355) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one
PubChem CID146125355
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one
SMILESCCn1ccnc(N2CCN(c3cc(OC)ccn3)CC2)c1=O
InChIInChI=1S/C16H21N5O2/c1-3-19-7-6-18-15(16(19)22)21-10-8-20(9-11-21)14-12-13(23-2)4-5-17-14/h4-7,12H,3,8-11H2,1-2H3
InChIKeyVPJDXZXMCISKAG-UHFFFAOYSA-N
XLogP0.99
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethyl-3-[4-(2-hydroxyphenyl)piperazin-1-yl]pyrazin-2-one
CID 133447156
1-ethyl-3-[4-(methylamino)piperidin-1-yl]pyrazin-2-one
CID 62939421
2-amino-1-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]ethanone
CID 119877691
4-(4-ethyl-3-oxopyrazin-2-yl)-N-methylpiperazine-1-sulfonamide
CID 154736074
3-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-1-ethylpyrazin-2-one
CID 55219868
7-bromo-5-fluoro-1-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]isoquinoline
CID 166336145
3-(3-aminopyrrolidin-1-yl)-1-ethylpyrazin-2-one
CID 62928142
[4-[[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]methyl]phenyl]methanol
CID 110008942
1-(4-methoxy-2-pyridinyl)-4-(2-pyridin-4-ylethyl)piperazine
CID 122158640
3-[4-[(3-ethoxyphenyl)methylamino]piperidin-1-yl]-1-ethylpyrazin-2-one
CID 128976328
3-(2,6-dimethylmorpholin-4-yl)-1-ethylpyrazin-2-one
CID 133446960
2-(4-ethyl-3-oxopyrazin-2-yl)oxy-4-methoxybenzoic acid
CID 62929919

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one?
The IUPAC name of 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one (CID 146125355) is 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one is CCn1ccnc(N2CCN(c3cc(OC)ccn3)CC2)c1=O.
What is the InChIKey of 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one?
The InChIKey is VPJDXZXMCISKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-3-19-7-6-18-15(16(19)22)21-10-8-20(9-11-21)14-12-13(23-2)4-5-17-14/h4-7,12H,3,8-11H2,1-2H3.
What are the key properties of 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one?
1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one has a molecular weight of 315.38 g/mol, XLogP of 0.99, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[4-(4-methoxy-2-pyridinyl)piperazin-1-yl]pyrazin-2-one is sourced from PubChem (CID 146125355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).