1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one

C147H145N19O10 — CID 158699718

IUPAC1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one
SMILESCC1NCCc2c1n(C)c1cc(-n3ccc(OCc4ccccc4)cc3=O)ccc21.CC1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc3n2C)CCN1C.CCOCn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CNCC2.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCCC5)c(=O)c2)cn1.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCNC5)c(=O)c2)cn1.Cn1c2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc31)CNCC2
InChIInChI=1S/C26H27N3O3.C26H27N3O2.C25H25N3O2.C24H23N3O.C23H22N4O.C23H21N3O/c1-2-31-18-29-24-10-12-27-16-23(24)22-9-8-20(14-25(22)29)28-13-11-21(15-26(28)30)32-17-19-6-4-3-5-7-19;1-18-26-23(12-13-27(18)2)22-10-9-20(15-24(22)28(26)3)29-14-11-21(16-25(29)30)31-17-19-7-5-4-6-8-19;1-17-25-22(10-12-26-17)21-9-8-19(14-23(21)27(25)2)28-13-11-20(15-24(28)29)30-16-18-6-4-3-5-7-18;1-16-7-8-18(15-25-16)17-11-12-27(24(28)13-17)19-9-10-21-20-5-3-4-6-22(20)26(2)23(21)14-19;1-15-3-4-17(13-25-15)16-8-10-27(23(28)11-16)18-5-6-19-20-14-24-9-7-21(20)26(2)22(19)12-18;1-25-21-9-11-24-15-20(21)19-8-7-18(14-22(19)25)26-12-10-17(13-23(26)27)16-5-3-2-4-6-16/h3-9,11,13-15,27H,2,10,12,16-18H2,1H3;4-11,14-16,18H,12-13,17H2,1-3H3;3-9,11,13-15,17,26H,10,12,16H2,1-2H3;7-15H,3-6H2,1-2H3;3-6,8,10-13,24H,7,9,14H2,1-2H3;2-8,10,12-14,24H,9,11,15H2,1H3
InChIKeyIHJSLGVCIJEJGW-UHFFFAOYSA-N
MW2337.90 g/mol
LogP24.15
Rot. Bonds21

About 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one

1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one (PubChem CID 158699718) has the molecular formula C147H145N19O10 and a molecular weight of 2337.90 g/mol. Its IUPAC name is 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one.

Molecular Properties

Compound Name1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one
PubChem CID158699718
Molecular FormulaC147H145N19O10
Molecular Weight2337.90 g/mol
Exact Mass2336.14
IUPAC Name1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one
SMILESCC1NCCc2c1n(C)c1cc(-n3ccc(OCc4ccccc4)cc3=O)ccc21.CC1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc3n2C)CCN1C.CCOCn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CNCC2.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCCC5)c(=O)c2)cn1.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCNC5)c(=O)c2)cn1.Cn1c2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc31)CNCC2
InChIInChI=1S/C26H27N3O3.C26H27N3O2.C25H25N3O2.C24H23N3O.C23H22N4O.C23H21N3O/c1-2-31-18-29-24-10-12-27-16-23(24)22-9-8-20(14-25(22)29)28-13-11-21(15-26(28)30)32-17-19-6-4-3-5-7-19;1-18-26-23(12-13-27(18)2)22-10-9-20(15-24(22)28(26)3)29-14-11-21(16-25(29)30)31-17-19-7-5-4-6-8-19;1-17-25-22(10-12-26-17)21-9-8-19(14-23(21)27(25)2)28-13-11-20(15-24(28)29)30-16-18-6-4-3-5-7-18;1-16-7-8-18(15-25-16)17-11-12-27(24(28)13-17)19-9-10-21-20-5-3-4-6-22(20)26(2)23(21)14-19;1-15-3-4-17(13-25-15)16-8-10-27(23(28)11-16)18-5-6-19-20-14-24-9-7-21(20)26(2)22(19)12-18;1-25-21-9-11-24-15-20(21)19-8-7-18(14-22(19)25)26-12-10-17(13-23(26)27)16-5-3-2-4-6-16/h3-9,11,13-15,27H,2,10,12,16-18H2,1H3;4-11,14-16,18H,12-13,17H2,1-3H3;3-9,11,13-15,17,26H,10,12,16H2,1-2H3;7-15H,3-6H2,1-2H3;3-6,8,10-13,24H,7,9,14H2,1-2H3;2-8,10,12-14,24H,9,11,15H2,1H3
InChIKeyIHJSLGVCIJEJGW-UHFFFAOYSA-N
XLogP24.15
TPSA275.64 Ų
H-Bond Donors4
H-Bond Acceptors29
Rotatable Bonds21
Heavy Atoms176
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002337.90
LogP ≤ 524.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

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

Analyze 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?
The IUPAC name of 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one (CID 158699718) is 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one.
What is the SMILES notation for 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?
The canonical SMILES for 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one is CC1NCCc2c1n(C)c1cc(-n3ccc(OCc4ccccc4)cc3=O)ccc21.CC1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc3n2C)CCN1C.CCOCn1c2c(c3ccc(-n4ccc(OCc5ccccc5)cc4=O)cc31)CNCC2.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCCC5)c(=O)c2)cn1.Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)CCNC5)c(=O)c2)cn1.Cn1c2c(c3ccc(-n4ccc(-c5ccccc5)cc4=O)cc31)CNCC2.
What is the InChIKey of 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?
The InChIKey is IHJSLGVCIJEJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O3.C26H27N3O2.C25H25N3O2.C24H23N3O.C23H22N4O.C23H21N3O/c1-2-31-18-29-24-10-12-27-16-23(24)22-9-8-20(14-25(22)29)28-13-11-21(15-26(28)30)32-17-19-6-4-3-5-7-19;1-18-26-23(12-13-27(18)2)22-10-9-20(15-24(22)28(26)3)29-14-11-21(16-25(29)30)31-17-19-7-5-4-6-8-19;1-17-25-22(10-12-26-17)21-9-8-19(14-23(21)27(25)2)28-13-11-20(15-24(28)29)30-16-18-6-4-3-5-7-18;1-16-7-8-18(15-25-16)17-11-12-27(24(28)13-17)19-9-10-21-20-5-3-4-6-22(20)26(2)23(21)14-19;1-15-3-4-17(13-25-15)16-8-10-27(23(28)11-16)18-5-6-19-20-14-24-9-7-21(20)26(2)22(19)12-18;1-25-21-9-11-24-15-20(21)19-8-7-18(14-22(19)25)26-12-10-17(13-23(26)27)16-5-3-2-4-6-16/h3-9,11,13-15,27H,2,10,12,16-18H2,1H3;4-11,14-16,18H,12-13,17H2,1-3H3;3-9,11,13-15,17,26H,10,12,16H2,1-2H3;7-15H,3-6H2,1-2H3;3-6,8,10-13,24H,7,9,14H2,1-2H3;2-8,10,12-14,24H,9,11,15H2,1H3.
What are the key properties of 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one?
1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one has a molecular weight of 2337.90 g/mol, XLogP of 24.15, 21 rotatable bonds, 4 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,9-dimethyl-1,2,3,4-tetrahydropyrido[3,4-b]indol-7-yl)-4-phenylmethoxypyridin-2-one;1-[5-(ethoxymethyl)-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl]-4-phenylmethoxypyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(6-methyl-3-pyridinyl)-1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)pyridin-2-one;1-(5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indol-7-yl)-4-phenylpyridin-2-one;4-phenylmethoxy-1-(1,2,9-trimethyl-3,4-dihydro-1H-pyrido[3,4-b]indol-7-yl)pyridin-2-one is sourced from PubChem (CID 158699718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).