6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

C110H89F3N18O15 — CID 157363888

IUPAC6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCOc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.COc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.Cc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cn1nc2ccc(C3CC3)cc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2ccc(OC(F)(F)F)cc2c1C1=Cc2nccc(C(=O)O)c2C1
InChIInChI=1S/C20H17N3O2.C18H12F3N3O3.2C18H15N3O3.2C18H15N3O2/c1-23-19(16-8-12(11-2-3-11)4-5-17(16)22-23)13-9-15-14(20(24)25)6-7-21-18(15)10-13;1-24-16(9-6-12-11(17(25)26)4-5-22-15(12)7-9)13-8-10(27-18(19,20)21)2-3-14(13)23-24;1-21-17(14-9-11(24-2)3-4-15(14)20-21)10-7-13-12(18(22)23)5-6-19-16(13)8-10;1-21-17(13-4-3-11(24-2)9-16(13)20-21)10-7-14-12(18(22)23)5-6-19-15(14)8-10;1-10-3-4-15-14(7-10)17(21(2)20-15)11-8-13-12(18(22)23)5-6-19-16(13)9-11;1-10-3-4-13-16(7-10)20-21(2)17(13)11-8-14-12(18(22)23)5-6-19-15(14)9-11/h4-8,10-11H,2-3,9H2,1H3,(H,24,25);2-5,7-8H,6H2,1H3,(H,25,26);2*3-6,8-9H,7H2,1-2H3,(H,22,23);2*3-7,9H,8H2,1-2H3,(H,22,23)
InChIKeyBIYLERBVIJOMDC-UHFFFAOYSA-N
MW1960.03 g/mol
LogP18.99
Rot. Bonds16

About 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (PubChem CID 157363888) has the molecular formula C110H89F3N18O15 and a molecular weight of 1960.03 g/mol. Its IUPAC name is 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
PubChem CID157363888
Molecular FormulaC110H89F3N18O15
Molecular Weight1960.03 g/mol
Exact Mass1958.67
IUPAC Name6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCOc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.COc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.Cc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cn1nc2ccc(C3CC3)cc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2ccc(OC(F)(F)F)cc2c1C1=Cc2nccc(C(=O)O)c2C1
InChIInChI=1S/C20H17N3O2.C18H12F3N3O3.2C18H15N3O3.2C18H15N3O2/c1-23-19(16-8-12(11-2-3-11)4-5-17(16)22-23)13-9-15-14(20(24)25)6-7-21-18(15)10-13;1-24-16(9-6-12-11(17(25)26)4-5-22-15(12)7-9)13-8-10(27-18(19,20)21)2-3-14(13)23-24;1-21-17(14-9-11(24-2)3-4-15(14)20-21)10-7-13-12(18(22)23)5-6-19-16(13)8-10;1-21-17(13-4-3-11(24-2)9-16(13)20-21)10-7-14-12(18(22)23)5-6-19-15(14)8-10;1-10-3-4-15-14(7-10)17(21(2)20-15)11-8-13-12(18(22)23)5-6-19-16(13)9-11;1-10-3-4-13-16(7-10)20-21(2)17(13)11-8-14-12(18(22)23)5-6-19-15(14)9-11/h4-8,10-11H,2-3,9H2,1H3,(H,24,25);2-5,7-8H,6H2,1H3,(H,25,26);2*3-6,8-9H,7H2,1-2H3,(H,22,23);2*3-7,9H,8H2,1-2H3,(H,22,23)
InChIKeyBIYLERBVIJOMDC-UHFFFAOYSA-N
XLogP18.99
TPSA435.75 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds16
Heavy Atoms146
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001960.03
LogP ≤ 518.99
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The IUPAC name of 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (CID 157363888) is 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is COc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.COc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cc1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.Cc1ccc2nn(C)c(C3=Cc4nccc(C(=O)O)c4C3)c2c1.Cn1nc2ccc(C3CC3)cc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2ccc(OC(F)(F)F)cc2c1C1=Cc2nccc(C(=O)O)c2C1.
What is the InChIKey of 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The InChIKey is BIYLERBVIJOMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2.C18H12F3N3O3.2C18H15N3O3.2C18H15N3O2/c1-23-19(16-8-12(11-2-3-11)4-5-17(16)22-23)13-9-15-14(20(24)25)6-7-21-18(15)10-13;1-24-16(9-6-12-11(17(25)26)4-5-22-15(12)7-9)13-8-10(27-18(19,20)21)2-3-14(13)23-24;1-21-17(14-9-11(24-2)3-4-15(14)20-21)10-7-13-12(18(22)23)5-6-19-16(13)8-10;1-21-17(13-4-3-11(24-2)9-16(13)20-21)10-7-14-12(18(22)23)5-6-19-15(14)8-10;1-10-3-4-15-14(7-10)17(21(2)20-15)11-8-13-12(18(22)23)5-6-19-16(13)9-11;1-10-3-4-13-16(7-10)20-21(2)17(13)11-8-14-12(18(22)23)5-6-19-15(14)9-11/h4-8,10-11H,2-3,9H2,1H3,(H,24,25);2-5,7-8H,6H2,1H3,(H,25,26);2*3-6,8-9H,7H2,1-2H3,(H,22,23);2*3-7,9H,8H2,1-2H3,(H,22,23).
What are the key properties of 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid has a molecular weight of 1960.03 g/mol, XLogP of 18.99, 16 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is sourced from PubChem (CID 157363888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).