2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

C22H22N4O3 — CID 155006947

IUPAC2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESCOC1=CC(c2nc3c(=O)cc[nH]c3nc2-c2ccccc2)=CN(C(C)C)C1O
InChIInChI=1S/C22H22N4O3/c1-13(2)26-12-15(11-17(29-3)22(26)28)19-18(14-7-5-4-6-8-14)25-21-20(24-19)16(27)9-10-23-21/h4-13,22,28H,1-3H3,(H,23,25,27)
InChIKeyVPMDJINMCCRVSQ-UHFFFAOYSA-N
MW390.44 g/mol
LogP2.90
Rot. Bonds4

About 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (PubChem CID 155006947) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.

Molecular Properties

Compound Name2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
PubChem CID155006947
Molecular FormulaC22H22N4O3
Molecular Weight390.44 g/mol
Exact Mass390.17
IUPAC Name2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESCOC1=CC(c2nc3c(=O)cc[nH]c3nc2-c2ccccc2)=CN(C(C)C)C1O
InChIInChI=1S/C22H22N4O3/c1-13(2)26-12-15(11-17(29-3)22(26)28)19-18(14-7-5-4-6-8-14)25-21-20(24-19)16(27)9-10-23-21/h4-13,22,28H,1-3H3,(H,23,25,27)
InChIKeyVPMDJINMCCRVSQ-UHFFFAOYSA-N
XLogP2.90
TPSA91.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-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

2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657088
2-bromo-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 137423280
3-(4-fluorophenyl)-2-(6-oxo-1-propan-2-yl-3-pyridinyl)-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656998
2-(5-chloro-1-cyclopropyl-6-oxo-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656659
2-(2-methoxy-4-pyridinyl)-3-[3-(trifluoromethyl)phenyl]-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657626
2-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-6-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657239
N,N-dimethyl-8-oxo-2-(6-oxo-1-propan-2-yl-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazine-7-carboxamide
CID 154656512
2-hydroxy-3-methoxy-1-phenyl-2H-pyrrol-5-one
CID 11608140
1-cyclopropyl-3-[8-oxo-2-(6-oxo-1-propan-2-yl-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-7-yl]urea
CID 154657504
6-cyclopropyl-2-(6-oxo-1-propan-2-yl-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657298
3-[2-(5-chloro-6-oxo-1-propan-2-yl-3-pyridinyl)-8-oxo-5H-pyrido[2,3-b]pyrazin-3-yl]-2-methylbenzonitrile
CID 154656600
7-(1-methylazetidin-3-yl)-2-(6-oxo-1-propan-2-yl-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656653

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The IUPAC name of 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (CID 155006947) is 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.
What is the SMILES notation for 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The canonical SMILES for 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is COC1=CC(c2nc3c(=O)cc[nH]c3nc2-c2ccccc2)=CN(C(C)C)C1O.
What is the InChIKey of 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The InChIKey is VPMDJINMCCRVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-13(2)26-12-15(11-17(29-3)22(26)28)19-18(14-7-5-4-6-8-14)25-21-20(24-19)16(27)9-10-23-21/h4-13,22,28H,1-3H3,(H,23,25,27).
What are the key properties of 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one has a molecular weight of 390.44 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-3-methoxy-1-propan-2-yl-2H-pyridin-5-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is sourced from PubChem (CID 155006947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).