N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane

C114H147F5N30O14 — CID 159068426

IUPACN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane
SMILESCCOCC.CCOCC.CCOCC.CCOCC.CCOCC.Nc1cc(OC2CCC(NC(=O)c3cc(C(F)(F)F)[nH]n3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cccnn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3ccncn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cncnc3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3nc(F)cc(F)n3)CC2)c2nccnc2c1
InChIInChI=1S/C19H19F3N6O2.3C19H20N6O2.C18H18F2N6O.5C4H10O/c20-19(21,22)16-9-14(27-28-16)18(29)26-11-1-3-12(4-2-11)30-15-8-10(23)7-13-17(15)25-6-5-24-13;20-13-7-16-18(24-6-5-23-16)17(8-13)27-15-3-1-14(2-4-15)25-19(26)12-9-21-11-22-10-12;20-12-9-16-18(23-8-7-22-16)17(10-12)27-14-3-1-13(2-4-14)25-19(26)15-5-6-21-11-24-15;20-12-10-16-18(22-9-8-21-16)17(11-12)27-14-5-3-13(4-6-14)24-19(26)15-2-1-7-23-25-15;19-15-9-16(20)26-18(25-15)24-11-1-3-12(4-2-11)27-14-8-10(21)7-13-17(14)23-6-5-22-13;5*1-3-5-4-2/h5-9,11-12H,1-4,23H2,(H,26,29)(H,27,28);5-11,14-15H,1-4,20H2,(H,25,26);5-11,13-14H,1-4,20H2,(H,25,26);1-2,7-11,13-14H,3-6,20H2,(H,24,26);5-9,11-12H,1-4,21H2,(H,24,25,26);5*3-4H2,1-2H3
InChIKeyJZIMZJLQYKIACU-UHFFFAOYSA-N
MW2256.62 g/mol
LogP17.74
Rot. Bonds30

About N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane

N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane (PubChem CID 159068426) has the molecular formula C114H147F5N30O14 and a molecular weight of 2256.62 g/mol. Its IUPAC name is N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane.

Molecular Properties

Compound NameN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane
PubChem CID159068426
Molecular FormulaC114H147F5N30O14
Molecular Weight2256.62 g/mol
Exact Mass2255.16
IUPAC NameN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane
SMILESCCOCC.CCOCC.CCOCC.CCOCC.CCOCC.Nc1cc(OC2CCC(NC(=O)c3cc(C(F)(F)F)[nH]n3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cccnn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3ccncn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cncnc3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3nc(F)cc(F)n3)CC2)c2nccnc2c1
InChIInChI=1S/C19H19F3N6O2.3C19H20N6O2.C18H18F2N6O.5C4H10O/c20-19(21,22)16-9-14(27-28-16)18(29)26-11-1-3-12(4-2-11)30-15-8-10(23)7-13-17(15)25-6-5-24-13;20-13-7-16-18(24-6-5-23-16)17(8-13)27-15-3-1-14(2-4-15)25-19(26)12-9-21-11-22-10-12;20-12-9-16-18(23-8-7-22-16)17(10-12)27-14-3-1-13(2-4-14)25-19(26)15-5-6-21-11-24-15;20-12-10-16-18(22-9-8-21-16)17(11-12)27-14-5-3-13(4-6-14)24-19(26)15-2-1-7-23-25-15;19-15-9-16(20)26-18(25-15)24-11-1-3-12(4-2-11)27-14-8-10(21)7-13-17(14)23-6-5-22-13;5*1-3-5-4-2/h5-9,11-12H,1-4,23H2,(H,26,29)(H,27,28);5-11,14-15H,1-4,20H2,(H,25,26);5-11,13-14H,1-4,20H2,(H,25,26);1-2,7-11,13-14H,3-6,20H2,(H,24,26);5-9,11-12H,1-4,21H2,(H,24,25,26);5*3-4H2,1-2H3
InChIKeyJZIMZJLQYKIACU-UHFFFAOYSA-N
XLogP17.74
TPSA611.53 Ų
H-Bond Donors11
H-Bond Acceptors39
Rotatable Bonds30
Heavy Atoms163
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002256.62
LogP ≤ 517.74
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane?
The IUPAC name of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane (CID 159068426) is N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane.
What is the SMILES notation for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane?
The canonical SMILES for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane is CCOCC.CCOCC.CCOCC.CCOCC.CCOCC.Nc1cc(OC2CCC(NC(=O)c3cc(C(F)(F)F)[nH]n3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cccnn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3ccncn3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(NC(=O)c3cncnc3)CC2)c2nccnc2c1.Nc1cc(OC2CCC(Nc3nc(F)cc(F)n3)CC2)c2nccnc2c1.
What is the InChIKey of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane?
The InChIKey is JZIMZJLQYKIACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N6O2.3C19H20N6O2.C18H18F2N6O.5C4H10O/c20-19(21,22)16-9-14(27-28-16)18(29)26-11-1-3-12(4-2-11)30-15-8-10(23)7-13-17(15)25-6-5-24-13;20-13-7-16-18(24-6-5-23-16)17(8-13)27-15-3-1-14(2-4-15)25-19(26)12-9-21-11-22-10-12;20-12-9-16-18(23-8-7-22-16)17(10-12)27-14-3-1-13(2-4-14)25-19(26)15-5-6-21-11-24-15;20-12-10-16-18(22-9-8-21-16)17(11-12)27-14-5-3-13(4-6-14)24-19(26)15-2-1-7-23-25-15;19-15-9-16(20)26-18(25-15)24-11-1-3-12(4-2-11)27-14-8-10(21)7-13-17(14)23-6-5-22-13;5*1-3-5-4-2/h5-9,11-12H,1-4,23H2,(H,26,29)(H,27,28);5-11,14-15H,1-4,20H2,(H,25,26);5-11,13-14H,1-4,20H2,(H,25,26);1-2,7-11,13-14H,3-6,20H2,(H,24,26);5-9,11-12H,1-4,21H2,(H,24,25,26);5*3-4H2,1-2H3.
What are the key properties of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane?
N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane has a molecular weight of 2256.62 g/mol, XLogP of 17.74, 30 rotatable bonds, 11 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-4-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide;N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide;8-[4-[(4,6-difluoropyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane is sourced from PubChem (CID 159068426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).