2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide

C122H143Cl2FN28O17 — CID 159532635

IUPAC2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ccc1F.CNC(=O)c1cccc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.COC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ncc1O.COc1c(Cl)ncnc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1.COc1cnc(Cl)nc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1
InChIInChI=1S/C26H30FN5O3.C25H30N6O3.C25H29N5O5.2C23H27ClN6O3/c1-28-26(33)21-14-18(4-7-22(21)27)31-17-2-5-20(6-3-17)35-24-16-19(32-10-12-34-13-11-32)15-23-25(24)30-9-8-29-23;1-26-25(32)20-3-2-4-23(30-20)29-17-5-7-19(8-6-17)34-22-16-18(31-11-13-33-14-12-31)15-21-24(22)28-10-9-27-21;1-33-25(32)19-14-23(28-15-21(19)31)29-16-2-4-18(5-3-16)35-22-13-17(30-8-10-34-11-9-30)12-20-24(22)27-7-6-26-20;1-31-21-22(24)27-14-28-23(21)29-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-20(19)26-7-6-25-18;1-31-20-14-27-23(24)29-22(20)28-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-21(19)26-7-6-25-18/h4,7-9,14-17,20,31H,2-3,5-6,10-13H2,1H3,(H,28,33);2-4,9-10,15-17,19H,5-8,11-14H2,1H3,(H,26,32)(H,29,30);6-7,12-16,18,31H,2-5,8-11H2,1H3,(H,28,29);2*6-7,12-15,17H,2-5,8-11H2,1H3,(H,27,28,29)
InChIKeyMDEQOVCGABZSQS-UHFFFAOYSA-N
MW2363.57 g/mol
LogP17.39
Rot. Bonds30

About 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide

2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide (PubChem CID 159532635) has the molecular formula C122H143Cl2FN28O17 and a molecular weight of 2363.57 g/mol. Its IUPAC name is 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide
PubChem CID159532635
Molecular FormulaC122H143Cl2FN28O17
Molecular Weight2363.57 g/mol
Exact Mass2361.05
IUPAC Name2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ccc1F.CNC(=O)c1cccc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.COC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ncc1O.COc1c(Cl)ncnc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1.COc1cnc(Cl)nc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1
InChIInChI=1S/C26H30FN5O3.C25H30N6O3.C25H29N5O5.2C23H27ClN6O3/c1-28-26(33)21-14-18(4-7-22(21)27)31-17-2-5-20(6-3-17)35-24-16-19(32-10-12-34-13-11-32)15-23-25(24)30-9-8-29-23;1-26-25(32)20-3-2-4-23(30-20)29-17-5-7-19(8-6-17)34-22-16-18(31-11-13-33-14-12-31)15-21-24(22)28-10-9-27-21;1-33-25(32)19-14-23(28-15-21(19)31)29-16-2-4-18(5-3-16)35-22-13-17(30-8-10-34-11-9-30)12-20-24(22)27-7-6-26-20;1-31-21-22(24)27-14-28-23(21)29-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-20(19)26-7-6-25-18;1-31-20-14-27-23(24)29-22(20)28-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-21(19)26-7-6-25-18/h4,7-9,14-17,20,31H,2-3,5-6,10-13H2,1H3,(H,28,33);2-4,9-10,15-17,19H,5-8,11-14H2,1H3,(H,26,32)(H,29,30);6-7,12-16,18,31H,2-5,8-11H2,1H3,(H,28,29);2*6-7,12-15,17H,2-5,8-11H2,1H3,(H,27,28,29)
InChIKeyMDEQOVCGABZSQS-UHFFFAOYSA-N
XLogP17.39
TPSA498.08 Ų
H-Bond Donors8
H-Bond Acceptors43
Rotatable Bonds30
Heavy Atoms170
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002363.57
LogP ≤ 517.39
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1043

Analyze 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide?
The IUPAC name of 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide (CID 159532635) is 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide.
What is the SMILES notation for 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide?
The canonical SMILES for 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide is CNC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ccc1F.CNC(=O)c1cccc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)n1.COC(=O)c1cc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)ncc1O.COc1c(Cl)ncnc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1.COc1cnc(Cl)nc1NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1.
What is the InChIKey of 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide?
The InChIKey is MDEQOVCGABZSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30FN5O3.C25H30N6O3.C25H29N5O5.2C23H27ClN6O3/c1-28-26(33)21-14-18(4-7-22(21)27)31-17-2-5-20(6-3-17)35-24-16-19(32-10-12-34-13-11-32)15-23-25(24)30-9-8-29-23;1-26-25(32)20-3-2-4-23(30-20)29-17-5-7-19(8-6-17)34-22-16-18(31-11-13-33-14-12-31)15-21-24(22)28-10-9-27-21;1-33-25(32)19-14-23(28-15-21(19)31)29-16-2-4-18(5-3-16)35-22-13-17(30-8-10-34-11-9-30)12-20-24(22)27-7-6-26-20;1-31-21-22(24)27-14-28-23(21)29-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-20(19)26-7-6-25-18;1-31-20-14-27-23(24)29-22(20)28-15-2-4-17(5-3-15)33-19-13-16(30-8-10-32-11-9-30)12-18-21(19)26-7-6-25-18/h4,7-9,14-17,20,31H,2-3,5-6,10-13H2,1H3,(H,28,33);2-4,9-10,15-17,19H,5-8,11-14H2,1H3,(H,26,32)(H,29,30);6-7,12-16,18,31H,2-5,8-11H2,1H3,(H,28,29);2*6-7,12-15,17H,2-5,8-11H2,1H3,(H,27,28,29).
What are the key properties of 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide?
2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide has a molecular weight of 2363.57 g/mol, XLogP of 17.39, 30 rotatable bonds, 8 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;6-chloro-5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine;2-fluoro-N-methyl-5-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]benzamide;methyl 5-hydroxy-2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-4-carboxylate;N-methyl-6-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]pyridine-2-carboxamide is sourced from PubChem (CID 159532635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).