1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol

C106H123ClN14O6 — CID 159792012

About 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol

1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol (PubChem CID 159792012) has the molecular formula C106H123ClN14O6 and a molecular weight of 1724.69 g/mol. Its IUPAC name is 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol.

Molecular Properties

• Compound Name: 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol
• PubChem CID: 159792012
• Molecular Formula: C106H123ClN14O6
• Molecular Weight: 1724.69 g/mol
• Exact Mass: 1722.94
• IUPAC Name: 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol
• SMILES: CC(=O)c1ncccc1C(C)(O)Cn1c2c(c3cc(C)ccc31)CN(C)CC2.CC(O)(Cn1c2c(c3cc(Cl)ccc31)CCCC2)c1cccnc1.CCC(O)(Cn1c2c(c3cc(C)ccc31)CN(C)CC2)c1cccnc1.CN1CCc2c(c3ccccc3n2CC(C)(O)c2cccnc2)C1.Cc1ccc2c(c1)c1c(n2CC(C)(O)c2cccnc2)CCN(C)C1
• InChI: InChI=1S/C23H27N3O2.C22H27N3O.C21H25N3O.C20H21ClN2O.C20H23N3O/c1-15-7-8-20-17(12-15)18-13-25(4)11-9-21(18)26(20)14-23(3,28)19-6-5-10-24-22(19)16(2)27;1-4-22(26,17-6-5-10-23-13-17)15-25-20-8-7-16(2)12-18(20)19-14-24(3)11-9-21(19)25;1-15-6-7-19-17(11-15)18-13-23(3)10-8-20(18)24(19)14-21(2,25)16-5-4-9-22-12-16;1-20(24,14-5-4-10-22-12-14)13-23-18-7-3-2-6-16(18)17-11-15(21)8-9-19(17)23;1-20(24,15-6-5-10-21-12-15)14-23-18-8-4-3-7-16(18)17-13-22(2)11-9-19(17)23/h5-8,10,12,28H,9,11,13-14H2,1-4H3;5-8,10,12-13,26H,4,9,11,14-15H2,1-3H3;4-7,9,11-12,25H,8,10,13-14H2,1-3H3;4-5,8-12,24H,2-3,6-7,13H2,1H3;3-8,10,12,24H,9,11,13-14H2,1-2H3
• InChIKey: NIRIESOSDGCUCM-UHFFFAOYSA-N
• XLogP: 17.72
• TPSA: 220.28 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 17
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1724.69
LogP ≤ 5	17.72
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol?

The IUPAC name of 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol (CID 159792012) is 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol.

What is the SMILES notation for 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol?

The canonical SMILES for 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol is CC(=O)c1ncccc1C(C)(O)Cn1c2c(c3cc(C)ccc31)CN(C)CC2.CC(O)(Cn1c2c(c3cc(Cl)ccc31)CCCC2)c1cccnc1.CCC(O)(Cn1c2c(c3cc(C)ccc31)CN(C)CC2)c1cccnc1.CN1CCc2c(c3ccccc3n2CC(C)(O)c2cccnc2)C1.Cc1ccc2c(c1)c1c(n2CC(C)(O)c2cccnc2)CCN(C)C1.

What is the InChIKey of 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol?

The InChIKey is NIRIESOSDGCUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O2.C22H27N3O.C21H25N3O.C20H21ClN2O.C20H23N3O/c1-15-7-8-20-17(12-15)18-13-25(4)11-9-21(18)26(20)14-23(3,28)19-6-5-10-24-22(19)16(2)27;1-4-22(26,17-6-5-10-23-13-17)15-25-20-8-7-16(2)12-18(20)19-14-24(3)11-9-21(19)25;1-15-6-7-19-17(11-15)18-13-23(3)10-8-20(18)24(19)14-21(2,25)16-5-4-9-22-12-16;1-20(24,14-5-4-10-22-12-14)13-23-18-7-3-2-6-16(18)17-11-15(21)8-9-19(17)23;1-20(24,15-6-5-10-21-12-15)14-23-18-8-4-3-7-16(18)17-13-22(2)11-9-19(17)23/h5-8,10,12,28H,9,11,13-14H2,1-4H3;5-8,10,12-13,26H,4,9,11,14-15H2,1-3H3;4-7,9,11-12,25H,8,10,13-14H2,1-3H3;4-5,8-12,24H,2-3,6-7,13H2,1H3;3-8,10,12,24H,9,11,13-14H2,1-2H3.

What are the key properties of 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol?

1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol has a molecular weight of 1724.69 g/mol, XLogP of 17.72, 17 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(6-chloro-1,2,3,4-tetrahydrocarbazol-9-yl)-2-pyridin-3-ylpropan-2-ol;1-[3-[1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-hydroxypropan-2-yl]-2-pyridinyl]ethanone;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylbutan-2-ol;1-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol;1-(2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-2-pyridin-3-ylpropan-2-ol is sourced from PubChem (CID 159792012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).