bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one

C143H131Cl2F2N17O8 — CID 158635603

IUPACbis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one
SMILESCn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(CCc5ccccc5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccn5)cc4=O)cc31)CCCC2
InChIInChI=1S/C26H26N2O.C24H22FN3O2.C24H23N3O2.2C23H20ClN3O.C23H20FN3O/c1-27-24-10-6-5-9-22(24)23-14-13-21(18-25(23)27)28-16-15-20(17-26(28)29)12-11-19-7-3-2-4-8-19;1-27-22-5-3-2-4-20(22)21-9-8-18(12-23(21)27)28-11-10-19(13-24(28)29)30-15-17-7-6-16(25)14-26-17;1-26-22-8-3-2-7-20(22)21-10-9-18(14-23(21)26)27-13-11-19(15-24(27)28)29-16-17-6-4-5-12-25-17;3*1-26-21-5-3-2-4-18(21)19-8-7-17(13-22(19)26)27-11-10-15(12-23(27)28)20-9-6-16(24)14-25-20/h2-4,7-8,13-18H,5-6,9-12H2,1H3;6-14H,2-5,15H2,1H3;4-6,9-15H,2-3,7-8,16H2,1H3;3*6-14H,2-5H2,1H3
InChIKeyHZSQLMJWVXREPR-UHFFFAOYSA-N
MW2324.63 g/mol
LogP27.75
Rot. Bonds18

About bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one

bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one (PubChem CID 158635603) has the molecular formula C143H131Cl2F2N17O8 and a molecular weight of 2324.63 g/mol. Its IUPAC name is bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one.

Molecular Properties

Compound Namebis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one
PubChem CID158635603
Molecular FormulaC143H131Cl2F2N17O8
Molecular Weight2324.63 g/mol
Exact Mass2321.97
IUPAC Namebis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one
SMILESCn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(CCc5ccccc5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccn5)cc4=O)cc31)CCCC2
InChIInChI=1S/C26H26N2O.C24H22FN3O2.C24H23N3O2.2C23H20ClN3O.C23H20FN3O/c1-27-24-10-6-5-9-22(24)23-14-13-21(18-25(23)27)28-16-15-20(17-26(28)29)12-11-19-7-3-2-4-8-19;1-27-22-5-3-2-4-20(22)21-9-8-18(12-23(21)27)28-11-10-19(13-24(28)29)30-15-17-7-6-16(25)14-26-17;1-26-22-8-3-2-7-20(22)21-10-9-18(14-23(21)26)27-13-11-19(15-24(27)28)29-16-17-6-4-5-12-25-17;3*1-26-21-5-3-2-4-18(21)19-8-7-17(13-22(19)26)27-11-10-15(12-23(27)28)20-9-6-16(24)14-25-20/h2-4,7-8,13-18H,5-6,9-12H2,1H3;6-14H,2-5,15H2,1H3;4-6,9-15H,2-3,7-8,16H2,1H3;3*6-14H,2-5H2,1H3
InChIKeyHZSQLMJWVXREPR-UHFFFAOYSA-N
XLogP27.75
TPSA244.49 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds18
Heavy Atoms172
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002324.63
LogP ≤ 527.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one?
The IUPAC name of bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one (CID 158635603) is bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one.
What is the SMILES notation for bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one?
The canonical SMILES for bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one is Cn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(-c5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(CCc5ccccc5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccc(F)cn5)cc4=O)cc31)CCCC2.Cn1c2c(c3ccc(-n4ccc(OCc5ccccn5)cc4=O)cc31)CCCC2.
What is the InChIKey of bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one?
The InChIKey is HZSQLMJWVXREPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O.C24H22FN3O2.C24H23N3O2.2C23H20ClN3O.C23H20FN3O/c1-27-24-10-6-5-9-22(24)23-14-13-21(18-25(23)27)28-16-15-20(17-26(28)29)12-11-19-7-3-2-4-8-19;1-27-22-5-3-2-4-20(22)21-9-8-18(12-23(21)27)28-11-10-19(13-24(28)29)30-15-17-7-6-16(25)14-26-17;1-26-22-8-3-2-7-20(22)21-10-9-18(14-23(21)26)27-13-11-19(15-24(27)28)29-16-17-6-4-5-12-25-17;3*1-26-21-5-3-2-4-18(21)19-8-7-17(13-22(19)26)27-11-10-15(12-23(27)28)20-9-6-16(24)14-25-20/h2-4,7-8,13-18H,5-6,9-12H2,1H3;6-14H,2-5,15H2,1H3;4-6,9-15H,2-3,7-8,16H2,1H3;3*6-14H,2-5H2,1H3.
What are the key properties of bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one?
bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one has a molecular weight of 2324.63 g/mol, XLogP of 27.75, 18 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-(5-chloro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one);4-[(5-fluoro-2-pyridinyl)methoxy]-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;4-(5-fluoro-2-pyridinyl)-1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(2-phenylethyl)pyridin-2-one;1-(9-methyl-5,6,7,8-tetrahydrocarbazol-2-yl)-4-(pyridin-2-ylmethoxy)pyridin-2-one is sourced from PubChem (CID 158635603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).