ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one

C18H22N4O3 — CID 91379636

IUPACethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one
SMILESCC.CNC(C)=O.O=c1cnc2c(Oc3ccccc3)ccnc2[nH]1
InChIInChI=1S/C13H9N3O2.C3H7NO.C2H6/c17-11-8-15-12-10(6-7-14-13(12)16-11)18-9-4-2-1-3-5-9;1-3(5)4-2;1-2/h1-8H,(H,14,16,17);1-2H3,(H,4,5);1-2H3
InChIKeyDQQAVYXJNGHVAO-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.89
Rot. Bonds2

About ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one

ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one (PubChem CID 91379636) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Nameethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one
PubChem CID91379636
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC Nameethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one
SMILESCC.CNC(C)=O.O=c1cnc2c(Oc3ccccc3)ccnc2[nH]1
InChIInChI=1S/C13H9N3O2.C3H7NO.C2H6/c17-11-8-15-12-10(6-7-14-13(12)16-11)18-9-4-2-1-3-5-9;1-3(5)4-2;1-2/h1-8H,(H,14,16,17);1-2H3,(H,4,5);1-2H3
InChIKeyDQQAVYXJNGHVAO-UHFFFAOYSA-N
XLogP2.89
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-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

tert-butyl N-[4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]carbamate
CID 46900574
8-(4-amino-3-ethylsulfanylphenoxy)-4H-pyrido[2,3-b]pyrazin-3-one
CID 155586197
tert-butyl N-[3-fluoro-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]carbamate
CID 59588862
1-[C-[(Z)-2-amino-2-cyclopropylethenyl]-N-phenylcarbonimidoyl]-3-[2-fluoro-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
CID 155586401
1-[C-[(Z)-2-amino-3,3-dimethylbut-1-enyl]-N-phenylcarbonimidoyl]-3-[6-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]-3-pyridinyl]urea
CID 155586595
8-tert-butyl-4H-pyrido[2,3-b]pyrazin-3-one
CID 140900846
1-phenoxy-5H-benzo[c][1,8]naphthyridin-6-one
CID 58168379
8-[4-[3-[4-chloro-3-(trifluoromethyl)phenyl]-2-oxopropyl]-3-fluorophenoxy]-4H-pyrido[2,3-b]pyrazin-3-one
CID 152922083
1-[C-[(Z)-2-amino-3,3-dimethylbut-1-enyl]-N-phenylcarbonimidoyl]-3-[3-methylsulfanyl-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
CID 155586283
1-[3-hydroxy-1-(6-methoxy-3-pyridinyl)pyrazol-5-yl]-3-[4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]naphthalen-1-yl]urea
CID 137301438
1-[1-(3,4-dichlorophenyl)-3-hydroxypyrazol-5-yl]-3-[4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]naphthalen-1-yl]urea
CID 137301428
(3-phenoxy-4-pyridinyl) propanoate
CID 19755132

Frequently Asked Questions

What is the IUPAC name of ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one?
The IUPAC name of ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one (CID 91379636) is ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one is CC.CNC(C)=O.O=c1cnc2c(Oc3ccccc3)ccnc2[nH]1.
What is the InChIKey of ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one?
The InChIKey is DQQAVYXJNGHVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O2.C3H7NO.C2H6/c17-11-8-15-12-10(6-7-14-13(12)16-11)18-9-4-2-1-3-5-9;1-3(5)4-2;1-2/h1-8H,(H,14,16,17);1-2H3,(H,4,5);1-2H3.
What are the key properties of ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one?
ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one has a molecular weight of 342.40 g/mol, XLogP of 2.89, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methylacetamide;8-phenoxy-4H-pyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 91379636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).