5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine

C23H25N7O2 — CID 71037792

IUPAC5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine
SMILESCC1(C)CN(C2CN(c3cnc4ccc(-c5ccc6oc(N)nc6c5)nc4n3)C2)CCO1
InChIInChI=1S/C23H25N7O2/c1-23(2)13-29(7-8-31-23)15-11-30(12-15)20-10-25-17-5-4-16(26-21(17)28-20)14-3-6-19-18(9-14)27-22(24)32-19/h3-6,9-10,15H,7-8,11-13H2,1-2H3,(H2,24,27)
InChIKeyVFRZXUJKNOTEIM-UHFFFAOYSA-N
MW431.50 g/mol
LogP2.71
Rot. Bonds3

About 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine

5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine (PubChem CID 71037792) has the molecular formula C23H25N7O2 and a molecular weight of 431.50 g/mol. Its IUPAC name is 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine.

Molecular Properties

Compound Name5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine
PubChem CID71037792
Molecular FormulaC23H25N7O2
Molecular Weight431.50 g/mol
Exact Mass431.21
IUPAC Name5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine
SMILESCC1(C)CN(C2CN(c3cnc4ccc(-c5ccc6oc(N)nc6c5)nc4n3)C2)CCO1
InChIInChI=1S/C23H25N7O2/c1-23(2)13-29(7-8-31-23)15-11-30(12-15)20-10-25-17-5-4-16(26-21(17)28-20)14-3-6-19-18(9-14)27-22(24)32-19/h3-6,9-10,15H,7-8,11-13H2,1-2H3,(H2,24,27)
InChIKeyVFRZXUJKNOTEIM-UHFFFAOYSA-N
XLogP2.71
TPSA106.43 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.50
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine 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 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine?
The IUPAC name of 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine (CID 71037792) is 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine.
What is the SMILES notation for 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine?
The canonical SMILES for 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine is CC1(C)CN(C2CN(c3cnc4ccc(-c5ccc6oc(N)nc6c5)nc4n3)C2)CCO1.
What is the InChIKey of 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine?
The InChIKey is VFRZXUJKNOTEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N7O2/c1-23(2)13-29(7-8-31-23)15-11-30(12-15)20-10-25-17-5-4-16(26-21(17)28-20)14-3-6-19-18(9-14)27-22(24)32-19/h3-6,9-10,15H,7-8,11-13H2,1-2H3,(H2,24,27).
What are the key properties of 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine?
5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine has a molecular weight of 431.50 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[3-(2,2-dimethylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazol-2-amine is sourced from PubChem (CID 71037792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).