4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one

C19H21N3O4 — CID 118071771

IUPAC4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCCC(Oc1ccc(CCO)cc1)C(=O)N1CC(=O)Nc2cccnc21
InChIInChI=1S/C19H21N3O4/c1-2-16(26-14-7-5-13(6-8-14)9-11-23)19(25)22-12-17(24)21-15-4-3-10-20-18(15)22/h3-8,10,16,23H,2,9,11-12H2,1H3,(H,21,24)
InChIKeyFUWUXTGHQAPOHB-UHFFFAOYSA-N
MW355.39 g/mol
LogP1.76
Rot. Bonds6

About 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one

4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one (PubChem CID 118071771) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
PubChem CID118071771
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCCC(Oc1ccc(CCO)cc1)C(=O)N1CC(=O)Nc2cccnc21
InChIInChI=1S/C19H21N3O4/c1-2-16(26-14-7-5-13(6-8-14)9-11-23)19(25)22-12-17(24)21-15-4-3-10-20-18(15)22/h3-8,10,16,23H,2,9,11-12H2,1H3,(H,21,24)
InChIKeyFUWUXTGHQAPOHB-UHFFFAOYSA-N
XLogP1.76
TPSA91.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]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

4-[2-[4-(5-methylpyrimidin-2-yl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
CID 118133459
3-fluoro-4-[4-[1-oxo-1-(2-oxo-1,3-dihydropyrido[2,3-b]pyrazin-4-yl)butan-2-yl]oxyphenyl]benzonitrile
CID 118133462
4-[2-[3-methyl-4-(5-methyl-1,2-oxazol-3-yl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
CID 118133460
4-[(2R)-2-phenoxybutanoyl]-1,3-dihydroquinoxalin-2-one
CID 40747048
4-[3-methyl-2-[4-(trifluoromethoxy)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one
CID 118071713
(2S)-2-phenoxy-1-[4-[(2S)-2-phenoxybutanoyl]piperazin-1-yl]butan-1-one
CID 7302330
4-[3-(4-propan-2-ylphenyl)propanoyl]-1,3-dihydroquinoxalin-2-one
CID 41453973
4-[2-(4-chlorophenoxy)propanoyl]-1,3-dihydroquinoxalin-2-one
CID 43818910
7-bromo-4-(2-methoxybutanoyl)-1,3-dihydroquinoxalin-2-one
CID 136518452
4-[(4-methoxyphenyl)methyl]-1,3-dihydropyrido[3,2-e][1,4]diazepine-2,5-dione
CID 102432545
(2R)-2-(4-ethylphenoxy)-1-(4-phenylpiperazin-1-yl)butan-1-one
CID 99132960
2-[4-(2-hydroxyethyl)phenoxy]-1-piperazin-1-ylpropan-1-one
CID 107708897

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The IUPAC name of 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one (CID 118071771) is 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one.
What is the SMILES notation for 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The canonical SMILES for 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one is CCC(Oc1ccc(CCO)cc1)C(=O)N1CC(=O)Nc2cccnc21.
What is the InChIKey of 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The InChIKey is FUWUXTGHQAPOHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-2-16(26-14-7-5-13(6-8-14)9-11-23)19(25)22-12-17(24)21-15-4-3-10-20-18(15)22/h3-8,10,16,23H,2,9,11-12H2,1H3,(H,21,24).
What are the key properties of 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one has a molecular weight of 355.39 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(2-hydroxyethyl)phenoxy]butanoyl]-1,3-dihydropyrido[2,3-b]pyrazin-2-one is sourced from PubChem (CID 118071771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).