4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine

C186H197F6N37O8S2 — CID 160799894

IUPAC4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine
SMILESCN(C)c1nc2cc(N3CCc4c([nH]c5ccc(F)cc45)C3)ccc2s1.Cn1c2c(c3cc(F)ccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)cn1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Fc1ccc2[nH]c3c(c2c1)CC1CCC3N1c1ccc(N2CCOCC2)cn1.Fc1ccc2[nH]c3c(c2c1)CCN(c1cc2sc(N4CCOCC4)nc2cn1)C3.Fc1ccc2[nH]c3c(c2c1)CCN(c1cnc(N2CCOCC2)c(F)c1)C3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)cn1)CC3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)nc1)CC3
InChIInChI=1S/C22H23FN4O.C21H20FN5OS.C21H23FN4O.2C21H24N4O.C20H20F2N4O.C20H19FN4S.2C20H22N4O/c23-14-1-4-19-17(11-14)18-12-15-2-5-20(22(18)25-19)27(15)21-6-3-16(13-24-21)26-7-9-28-10-8-26;22-13-1-2-16-15(9-13)14-3-4-27(12-18(14)24-16)20-10-19-17(11-23-20)25-21(29-19)26-5-7-28-8-6-26;1-24-19-4-2-15(22)12-18(19)17-6-7-26(14-20(17)24)16-3-5-21(23-13-16)25-8-10-27-11-9-25;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)16-6-7-21(22-14-16)24-10-12-26-13-11-24;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)21-7-6-16(14-22-21)24-10-12-26-13-11-24;21-13-1-2-18-16(9-13)15-3-4-26(12-19(15)24-18)14-10-17(22)20(23-11-14)25-5-7-27-8-6-25;1-24(2)20-23-17-10-13(4-6-19(17)26-20)25-8-7-14-15-9-12(21)3-5-16(15)22-18(14)11-25;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)15-5-6-20(21-13-15)23-9-11-25-12-10-23;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)20-6-5-15(13-21-20)23-9-11-25-12-10-23/h1,3-4,6,11,13,15,20,25H,2,5,7-10,12H2;1-2,9-11,24H,3-8,12H2;2-5,12-13H,6-11,14H2,1H3;2*2-7,14H,8-13,15H2,1H3;1-2,9-11,24H,3-8,12H2;3-6,9-10,22H,7-8,11H2,1-2H3;2*1-6,13,22H,7-12,14H2
InChIKeySCXYXBWEZSKIIA-UHFFFAOYSA-N
MW3256.99 g/mol
LogP30.28
Rot. Bonds18

About 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine

4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine (PubChem CID 160799894) has the molecular formula C186H197F6N37O8S2 and a molecular weight of 3256.99 g/mol. Its IUPAC name is 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine
PubChem CID160799894
Molecular FormulaC186H197F6N37O8S2
Molecular Weight3256.99 g/mol
Exact Mass3254.55
IUPAC Name4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine
SMILESCN(C)c1nc2cc(N3CCc4c([nH]c5ccc(F)cc45)C3)ccc2s1.Cn1c2c(c3cc(F)ccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)cn1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Fc1ccc2[nH]c3c(c2c1)CC1CCC3N1c1ccc(N2CCOCC2)cn1.Fc1ccc2[nH]c3c(c2c1)CCN(c1cc2sc(N4CCOCC4)nc2cn1)C3.Fc1ccc2[nH]c3c(c2c1)CCN(c1cnc(N2CCOCC2)c(F)c1)C3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)cn1)CC3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)nc1)CC3
InChIInChI=1S/C22H23FN4O.C21H20FN5OS.C21H23FN4O.2C21H24N4O.C20H20F2N4O.C20H19FN4S.2C20H22N4O/c23-14-1-4-19-17(11-14)18-12-15-2-5-20(22(18)25-19)27(15)21-6-3-16(13-24-21)26-7-9-28-10-8-26;22-13-1-2-16-15(9-13)14-3-4-27(12-18(14)24-16)20-10-19-17(11-23-20)25-21(29-19)26-5-7-28-8-6-26;1-24-19-4-2-15(22)12-18(19)17-6-7-26(14-20(17)24)16-3-5-21(23-13-16)25-8-10-27-11-9-25;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)16-6-7-21(22-14-16)24-10-12-26-13-11-24;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)21-7-6-16(14-22-21)24-10-12-26-13-11-24;21-13-1-2-18-16(9-13)15-3-4-26(12-19(15)24-18)14-10-17(22)20(23-11-14)25-5-7-27-8-6-25;1-24(2)20-23-17-10-13(4-6-19(17)26-20)25-8-7-14-15-9-12(21)3-5-16(15)22-18(14)11-25;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)15-5-6-20(21-13-15)23-9-11-25-12-10-23;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)20-6-5-15(13-21-20)23-9-11-25-12-10-23/h1,3-4,6,11,13,15,20,25H,2,5,7-10,12H2;1-2,9-11,24H,3-8,12H2;2-5,12-13H,6-11,14H2,1H3;2*2-7,14H,8-13,15H2,1H3;1-2,9-11,24H,3-8,12H2;3-6,9-10,22H,7-8,11H2,1-2H3;2*1-6,13,22H,7-12,14H2
InChIKeySCXYXBWEZSKIIA-UHFFFAOYSA-N
XLogP30.28
TPSA370.59 Ų
H-Bond Donors6
H-Bond Acceptors41
Rotatable Bonds18
Heavy Atoms239
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003256.99
LogP ≤ 530.28
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine?
The IUPAC name of 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine (CID 160799894) is 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine.
What is the SMILES notation for 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine?
The canonical SMILES for 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine is CN(C)c1nc2cc(N3CCc4c([nH]c5ccc(F)cc45)C3)ccc2s1.Cn1c2c(c3cc(F)ccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)cn1)C2.Cn1c2c(c3ccccc31)CCN(c1ccc(N3CCOCC3)nc1)C2.Fc1ccc2[nH]c3c(c2c1)CC1CCC3N1c1ccc(N2CCOCC2)cn1.Fc1ccc2[nH]c3c(c2c1)CCN(c1cc2sc(N4CCOCC4)nc2cn1)C3.Fc1ccc2[nH]c3c(c2c1)CCN(c1cnc(N2CCOCC2)c(F)c1)C3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)cn1)CC3.c1ccc2c3c([nH]c2c1)CN(c1ccc(N2CCOCC2)nc1)CC3.
What is the InChIKey of 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine?
The InChIKey is SCXYXBWEZSKIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O.C21H20FN5OS.C21H23FN4O.2C21H24N4O.C20H20F2N4O.C20H19FN4S.2C20H22N4O/c23-14-1-4-19-17(11-14)18-12-15-2-5-20(22(18)25-19)27(15)21-6-3-16(13-24-21)26-7-9-28-10-8-26;22-13-1-2-16-15(9-13)14-3-4-27(12-18(14)24-16)20-10-19-17(11-23-20)25-21(29-19)26-5-7-28-8-6-26;1-24-19-4-2-15(22)12-18(19)17-6-7-26(14-20(17)24)16-3-5-21(23-13-16)25-8-10-27-11-9-25;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)16-6-7-21(22-14-16)24-10-12-26-13-11-24;1-23-19-5-3-2-4-17(19)18-8-9-25(15-20(18)23)21-7-6-16(14-22-21)24-10-12-26-13-11-24;21-13-1-2-18-16(9-13)15-3-4-26(12-19(15)24-18)14-10-17(22)20(23-11-14)25-5-7-27-8-6-25;1-24(2)20-23-17-10-13(4-6-19(17)26-20)25-8-7-14-15-9-12(21)3-5-16(15)22-18(14)11-25;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)15-5-6-20(21-13-15)23-9-11-25-12-10-23;1-2-4-18-16(3-1)17-7-8-24(14-19(17)22-18)20-6-5-15(13-21-20)23-9-11-25-12-10-23/h1,3-4,6,11,13,15,20,25H,2,5,7-10,12H2;1-2,9-11,24H,3-8,12H2;2-5,12-13H,6-11,14H2,1H3;2*2-7,14H,8-13,15H2,1H3;1-2,9-11,24H,3-8,12H2;3-6,9-10,22H,7-8,11H2,1-2H3;2*1-6,13,22H,7-12,14H2.
What are the key properties of 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine?
4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine has a molecular weight of 3256.99 g/mol, XLogP of 30.28, 18 rotatable bonds, 6 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(7-fluoro-3,15-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2(10),4(9),5,7-tetraen-15-yl)-3-pyridinyl]morpholine;4-[3-fluoro-5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[5-(6-fluoro-9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;5-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-N,N-dimethyl-1,3-benzothiazol-2-amine;4-[6-(6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]morpholine;4-[5-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(9-methyl-3,4-dihydro-1H-pyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine;4-[5-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-2-pyridinyl]morpholine;4-[6-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)-3-pyridinyl]morpholine is sourced from PubChem (CID 160799894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).