2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide

C92H109F6N23O13 — CID 160802234

IUPAC2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
SMILESCOc1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)nc(OC)n1.Cc1ccnc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.O=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1cc(C(F)(F)F)[nH]n1.OC1(C(F)(F)F)C/C(=N/C2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)NO1
InChIInChI=1S/C24H30N6O4.C23H25F3N6O3.C23H28N6O2.C22H26F3N5O4/c1-31-22-15-21(28-24(29-22)32-2)27-16-3-5-18(6-4-16)34-20-14-17(30-9-11-33-12-10-30)13-19-23(20)26-8-7-25-19;24-23(25,26)20-13-18(30-31-20)22(33)29-14-1-3-16(4-2-14)35-19-12-15(32-7-9-34-10-8-32)11-17-21(19)28-6-5-27-17;1-16-6-7-26-23(27-16)28-17-2-4-19(5-3-17)31-21-15-18(29-10-12-30-13-11-29)14-20-22(21)25-9-8-24-20;23-22(24,25)21(31)13-19(29-34-21)28-14-1-3-16(4-2-14)33-18-12-15(30-7-9-32-10-8-30)11-17-20(18)27-6-5-26-17/h7-8,13-16,18H,3-6,9-12H2,1-2H3,(H,27,28,29);5-6,11-14,16H,1-4,7-10H2,(H,29,33)(H,30,31);6-9,14-15,17,19H,2-5,10-13H2,1H3,(H,26,27,28);5-6,11-12,14,16,31H,1-4,7-10,13H2,(H,28,29)
InChIKeySDFQUHYONYBDNK-UHFFFAOYSA-N
MW1859.02 g/mol
LogP12.50
Rot. Bonds21

About 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide

2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide (PubChem CID 160802234) has the molecular formula C92H109F6N23O13 and a molecular weight of 1859.02 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
PubChem CID160802234
Molecular FormulaC92H109F6N23O13
Molecular Weight1859.02 g/mol
Exact Mass1857.85
IUPAC Name2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
SMILESCOc1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)nc(OC)n1.Cc1ccnc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.O=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1cc(C(F)(F)F)[nH]n1.OC1(C(F)(F)F)C/C(=N/C2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)NO1
InChIInChI=1S/C24H30N6O4.C23H25F3N6O3.C23H28N6O2.C22H26F3N5O4/c1-31-22-15-21(28-24(29-22)32-2)27-16-3-5-18(6-4-16)34-20-14-17(30-9-11-33-12-10-30)13-19-23(20)26-8-7-25-19;24-23(25,26)20-13-18(30-31-20)22(33)29-14-1-3-16(4-2-14)35-19-12-15(32-7-9-34-10-8-32)11-17-21(19)28-6-5-27-17;1-16-6-7-26-23(27-16)28-17-2-4-19(5-3-17)31-21-15-18(29-10-12-30-13-11-29)14-20-22(21)25-9-8-24-20;23-22(24,25)21(31)13-19(29-34-21)28-14-1-3-16(4-2-14)33-18-12-15(30-7-9-32-10-8-30)11-17-20(18)27-6-5-26-17/h7-8,13-16,18H,3-6,9-12H2,1-2H3,(H,27,28,29);5-6,11-14,16H,1-4,7-10H2,(H,29,33)(H,30,31);6-9,14-15,17,19H,2-5,10-13H2,1H3,(H,26,27,28);5-6,11-12,14,16,31H,1-4,7-10,13H2,(H,28,29)
InChIKeySDFQUHYONYBDNK-UHFFFAOYSA-N
XLogP12.50
TPSA395.63 Ų
H-Bond Donors6
H-Bond Acceptors33
Rotatable Bonds21
Heavy Atoms134
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001859.02
LogP ≤ 512.50
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide 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 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide (CID 160802234) is 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is COc1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)nc(OC)n1.Cc1ccnc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.O=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1cc(C(F)(F)F)[nH]n1.OC1(C(F)(F)F)C/C(=N/C2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)NO1.
What is the InChIKey of 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is SDFQUHYONYBDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O4.C23H25F3N6O3.C23H28N6O2.C22H26F3N5O4/c1-31-22-15-21(28-24(29-22)32-2)27-16-3-5-18(6-4-16)34-20-14-17(30-9-11-33-12-10-30)13-19-23(20)26-8-7-25-19;24-23(25,26)20-13-18(30-31-20)22(33)29-14-1-3-16(4-2-14)35-19-12-15(32-7-9-34-10-8-32)11-17-21(19)28-6-5-27-17;1-16-6-7-26-23(27-16)28-17-2-4-19(5-3-17)31-21-15-18(29-10-12-30-13-11-29)14-20-22(21)25-9-8-24-20;23-22(24,25)21(31)13-19(29-34-21)28-14-1-3-16(4-2-14)33-18-12-15(30-7-9-32-10-8-30)11-17-20(18)27-6-5-26-17/h7-8,13-16,18H,3-6,9-12H2,1-2H3,(H,27,28,29);5-6,11-14,16H,1-4,7-10H2,(H,29,33)(H,30,31);6-9,14-15,17,19H,2-5,10-13H2,1H3,(H,26,27,28);5-6,11-12,14,16,31H,1-4,7-10,13H2,(H,28,29).
What are the key properties of 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide?
2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 1859.02 g/mol, XLogP of 12.50, 21 rotatable bonds, 6 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine;3-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]imino-5-(trifluoromethyl)-1,2-oxazolidin-5-ol;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 160802234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).