2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide

C145H154N32O11 — CID 160837681

IUPAC2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide
SMILESCNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C)CC(=O)N32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C4CC4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccccc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4cccnc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccncc4)CCN32)ncc1C
InChIInChI=1S/C31H32N6O2.2C30H31N7O2.C28H32N6O2.C26H28N6O3/c1-21-18-33-30(17-27(21)35-26-11-7-6-10-25(26)31(38)32-2)34-22-12-13-28-29(16-22)39-20-24-19-36(14-15-37(24)28)23-8-4-3-5-9-23;1-20-16-33-29(15-26(20)35-25-8-4-3-7-24(25)30(38)31-2)34-21-9-10-27-28(14-21)39-19-23-18-36(12-13-37(23)27)22-6-5-11-32-17-22;1-20-17-33-29(16-26(20)35-25-6-4-3-5-24(25)30(38)31-2)34-21-7-8-27-28(15-21)39-19-23-18-36(13-14-37(23)27)22-9-11-32-12-10-22;1-18-15-30-27(14-24(18)32-23-6-4-3-5-22(23)28(35)29-2)31-19-7-10-25-26(13-19)36-17-21-16-33(20-8-9-20)11-12-34(21)25;1-16-12-28-24(11-21(16)30-20-7-5-4-6-19(20)26(34)27-2)29-17-8-9-22-23(10-17)35-15-18-13-31(3)14-25(33)32(18)22/h3-13,16-18,24H,14-15,19-20H2,1-2H3,(H,32,38)(H2,33,34,35);3-11,14-17,23H,12-13,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-12,15-17,23H,13-14,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-7,10,13-15,20-21H,8-9,11-12,16-17H2,1-2H3,(H,29,35)(H2,30,31,32);4-12,18H,13-15H2,1-3H3,(H,27,34)(H2,28,29,30)
InChIKeySHPSTIUJXVEEBA-UHFFFAOYSA-N
MW2521.04 g/mol
LogP22.32
Rot. Bonds29

About 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide

2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide (PubChem CID 160837681) has the molecular formula C145H154N32O11 and a molecular weight of 2521.04 g/mol. Its IUPAC name is 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide
PubChem CID160837681
Molecular FormulaC145H154N32O11
Molecular Weight2521.04 g/mol
Exact Mass2519.25
IUPAC Name2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide
SMILESCNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C)CC(=O)N32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C4CC4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccccc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4cccnc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccncc4)CCN32)ncc1C
InChIInChI=1S/C31H32N6O2.2C30H31N7O2.C28H32N6O2.C26H28N6O3/c1-21-18-33-30(17-27(21)35-26-11-7-6-10-25(26)31(38)32-2)34-22-12-13-28-29(16-22)39-20-24-19-36(14-15-37(24)28)23-8-4-3-5-9-23;1-20-16-33-29(15-26(20)35-25-8-4-3-7-24(25)30(38)31-2)34-21-9-10-27-28(14-21)39-19-23-18-36(12-13-37(23)27)22-6-5-11-32-17-22;1-20-17-33-29(16-26(20)35-25-6-4-3-5-24(25)30(38)31-2)34-21-7-8-27-28(15-21)39-19-23-18-36(13-14-37(23)27)22-9-11-32-12-10-22;1-18-15-30-27(14-24(18)32-23-6-4-3-5-22(23)28(35)29-2)31-19-7-10-25-26(13-19)36-17-21-16-33(20-8-9-20)11-12-34(21)25;1-16-12-28-24(11-21(16)30-20-7-5-4-6-19(20)26(34)27-2)29-17-8-9-22-23(10-17)35-15-18-13-31(3)14-25(33)32(18)22/h3-13,16-18,24H,14-15,19-20H2,1-2H3,(H,32,38)(H2,33,34,35);3-11,14-17,23H,12-13,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-12,15-17,23H,13-14,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-7,10,13-15,20-21H,8-9,11-12,16-17H2,1-2H3,(H,29,35)(H2,30,31,32);4-12,18H,13-15H2,1-3H3,(H,27,34)(H2,28,29,30)
InChIKeySHPSTIUJXVEEBA-UHFFFAOYSA-N
XLogP22.32
TPSA451.65 Ų
H-Bond Donors15
H-Bond Acceptors37
Rotatable Bonds29
Heavy Atoms188
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002521.04
LogP ≤ 522.32
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1037

Analyze 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide?
The IUPAC name of 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide (CID 160837681) is 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide.
What is the SMILES notation for 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide?
The canonical SMILES for 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide is CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C)CC(=O)N32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(C4CC4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccccc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4cccnc4)CCN32)ncc1C.CNC(=O)c1ccccc1Nc1cc(Nc2ccc3c(c2)OCC2CN(c4ccncc4)CCN32)ncc1C.
What is the InChIKey of 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide?
The InChIKey is SHPSTIUJXVEEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32N6O2.2C30H31N7O2.C28H32N6O2.C26H28N6O3/c1-21-18-33-30(17-27(21)35-26-11-7-6-10-25(26)31(38)32-2)34-22-12-13-28-29(16-22)39-20-24-19-36(14-15-37(24)28)23-8-4-3-5-9-23;1-20-16-33-29(15-26(20)35-25-8-4-3-7-24(25)30(38)31-2)34-21-9-10-27-28(14-21)39-19-23-18-36(12-13-37(23)27)22-6-5-11-32-17-22;1-20-17-33-29(16-26(20)35-25-6-4-3-5-24(25)30(38)31-2)34-21-7-8-27-28(15-21)39-19-23-18-36(13-14-37(23)27)22-9-11-32-12-10-22;1-18-15-30-27(14-24(18)32-23-6-4-3-5-22(23)28(35)29-2)31-19-7-10-25-26(13-19)36-17-21-16-33(20-8-9-20)11-12-34(21)25;1-16-12-28-24(11-21(16)30-20-7-5-4-6-19(20)26(34)27-2)29-17-8-9-22-23(10-17)35-15-18-13-31(3)14-25(33)32(18)22/h3-13,16-18,24H,14-15,19-20H2,1-2H3,(H,32,38)(H2,33,34,35);3-11,14-17,23H,12-13,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-12,15-17,23H,13-14,18-19H2,1-2H3,(H,31,38)(H2,33,34,35);3-7,10,13-15,20-21H,8-9,11-12,16-17H2,1-2H3,(H,29,35)(H2,30,31,32);4-12,18H,13-15H2,1-3H3,(H,27,34)(H2,28,29,30).
What are the key properties of 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide?
2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide has a molecular weight of 2521.04 g/mol, XLogP of 22.32, 29 rotatable bonds, 15 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(3-cyclopropyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-5-methyl-4-pyridinyl]amino]-N-methylbenzamide;N-methyl-2-[[5-methyl-2-[(3-methyl-1-oxo-2,4,4a,5-tetrahydropyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-phenyl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-3-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide;N-methyl-2-[[5-methyl-2-[(3-pyridin-4-yl-2,4,4a,5-tetrahydro-1H-pyrazino[2,1-c][1,4]benzoxazin-8-yl)amino]-4-pyridinyl]amino]benzamide is sourced from PubChem (CID 160837681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).