4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine

C23H23F2N5O — CID 24853330

IUPAC4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine
SMILESFc1ccc(F)c(CN2CCNc3ncc(-c4ccc(N5CCOCC5)nc4)cc32)c1
InChIInChI=1S/C23H23F2N5O/c24-19-2-3-20(25)18(11-19)15-30-6-5-26-23-21(30)12-17(14-28-23)16-1-4-22(27-13-16)29-7-9-31-10-8-29/h1-4,11-14H,5-10,15H2,(H,26,28)
InChIKeyYNLFNHQWXAAUEH-UHFFFAOYSA-N
MW423.47 g/mol
LogP3.69
Rot. Bonds4

About 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine

4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine (PubChem CID 24853330) has the molecular formula C23H23F2N5O and a molecular weight of 423.47 g/mol. Its IUPAC name is 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine
PubChem CID24853330
Molecular FormulaC23H23F2N5O
Molecular Weight423.47 g/mol
Exact Mass423.19
IUPAC Name4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine
SMILESFc1ccc(F)c(CN2CCNc3ncc(-c4ccc(N5CCOCC5)nc4)cc32)c1
InChIInChI=1S/C23H23F2N5O/c24-19-2-3-20(25)18(11-19)15-30-6-5-26-23-21(30)12-17(14-28-23)16-1-4-22(27-13-16)29-7-9-31-10-8-29/h1-4,11-14H,5-10,15H2,(H,26,28)
InChIKeyYNLFNHQWXAAUEH-UHFFFAOYSA-N
XLogP3.69
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine (CID 24853330) is 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine is Fc1ccc(F)c(CN2CCNc3ncc(-c4ccc(N5CCOCC5)nc4)cc32)c1.
What is the InChIKey of 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine?
The InChIKey is YNLFNHQWXAAUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23F2N5O/c24-19-2-3-20(25)18(11-19)15-30-6-5-26-23-21(30)12-17(14-28-23)16-1-4-22(27-13-16)29-7-9-31-10-8-29/h1-4,11-14H,5-10,15H2,(H,26,28).
What are the key properties of 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine?
4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine has a molecular weight of 423.47 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[1-[(2,5-difluorophenyl)methyl]-3,4-dihydro-2H-pyrido[2,3-b]pyrazin-7-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 24853330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).