6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione

C15H13N3O3 — CID 127049188

IUPAC6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione
SMILESO=c1[nH]c2ccc(OCCc3ccccc3)nc2[nH]c1=O
InChIInChI=1S/C15H13N3O3/c19-14-15(20)18-13-11(16-14)6-7-12(17-13)21-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,16,19)(H,17,18,20)
InChIKeyKKOQNEKPTCRKKF-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.23
Rot. Bonds4

About 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione

6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione (PubChem CID 127049188) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione.

Molecular Properties

Compound Name6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione
PubChem CID127049188
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione
SMILESO=c1[nH]c2ccc(OCCc3ccccc3)nc2[nH]c1=O
InChIInChI=1S/C15H13N3O3/c19-14-15(20)18-13-11(16-14)6-7-12(17-13)21-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,16,19)(H,17,18,20)
InChIKeyKKOQNEKPTCRKKF-UHFFFAOYSA-N
XLogP1.23
TPSA87.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione with MolForge

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Related Compounds

8-(3-phenylpropoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione
CID 127050455
6-(2-phenylethoxy)pyridin-2-amine
CID 141303367
6-(2-phenylethoxy)pyridine-2-carboxylic acid
CID 115001122
[6-(2-phenylethoxy)-2-pyridinyl]methanol
CID 115000798
2-ethoxy-6-(2-phenylethoxy)pyridin-3-amine
CID 43262503
5-(2-phenylethoxy)-1H-pyrrolo[2,3-c]pyridine
CID 174248921
5-ethenyl-2-(2-phenylethoxy)pyridine
CID 175471058
6,7,15,16,24,25,33,34-octakis(2-phenylethoxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene
CID 155397258
CID 58731637
CID 58731637
4-hydrazinyl-6-(3-phenylpropoxy)pyrimidin-2-amine
CID 80930333
2,3-dioxo-N-(4-phenylbutyl)-1,4-dihydroquinoxaline-6-sulfonamide
CID 24622217
3-(3-oxo-4H-quinoxalin-2-yl)-N-[(E)-[4-(2-phenylethoxy)phenyl]methylideneamino]propanamide
CID 110338874

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione?
The IUPAC name of 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione (CID 127049188) is 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione.
What is the SMILES notation for 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione?
The canonical SMILES for 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione is O=c1[nH]c2ccc(OCCc3ccccc3)nc2[nH]c1=O.
What is the InChIKey of 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione?
The InChIKey is KKOQNEKPTCRKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c19-14-15(20)18-13-11(16-14)6-7-12(17-13)21-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,16,19)(H,17,18,20).
What are the key properties of 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione?
6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione has a molecular weight of 283.29 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenylethoxy)-1,4-dihydropyrido[2,3-b]pyrazine-2,3-dione is sourced from PubChem (CID 127049188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).