6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

C128H110N20O11 — CID 159857580

IUPAC6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCCN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CC3CC3)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CCO)nc2c1.Cn1nc2cc(N3CCCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2cc(N3CCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1
InChIInChI=1S/C27H24N4O2.C26H22N4O2.C25H22N4O3.C25H20N4O2.C25H22N4O2/c1-30(19-5-3-2-4-6-19)20-9-10-22-25(15-20)29-31(16-17-7-8-17)26(22)18-13-23-21(27(32)33)11-12-28-24(23)14-18;1-29-25(17-13-21-19(26(31)32)10-11-27-22(21)14-17)20-9-8-18(15-23(20)28-29)30-12-4-6-16-5-2-3-7-24(16)30;1-28(17-5-3-2-4-6-17)18-7-8-20-23(15-18)27-29(11-12-30)24(20)16-13-21-19(25(31)32)9-10-26-22(21)14-16;1-28-24(16-12-20-18(25(30)31)8-10-26-21(20)13-16)19-7-6-17(14-22(19)27-28)29-11-9-15-4-2-3-5-23(15)29;1-3-29(17-7-5-4-6-8-17)18-9-10-20-23(15-18)27-28(2)24(20)16-13-21-19(25(30)31)11-12-26-22(21)14-16/h2-6,9-12,14-15,17H,7-8,13,16H2,1H3,(H,32,33);2-3,5,7-11,14-15H,4,6,12-13H2,1H3,(H,31,32);2-10,14-15,30H,11-13H2,1H3,(H,31,32);2-8,10,13-14H,9,11-12H2,1H3,(H,30,31);4-12,14-15H,3,13H2,1-2H3,(H,30,31)
InChIKeyNQSKUIQOJLPZOQ-UHFFFAOYSA-N
MW2104.42 g/mol
LogP23.62
Rot. Bonds23

About 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (PubChem CID 159857580) has the molecular formula C128H110N20O11 and a molecular weight of 2104.42 g/mol. Its IUPAC name is 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
PubChem CID159857580
Molecular FormulaC128H110N20O11
Molecular Weight2104.42 g/mol
Exact Mass2102.87
IUPAC Name6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCCN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CC3CC3)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CCO)nc2c1.Cn1nc2cc(N3CCCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2cc(N3CCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1
InChIInChI=1S/C27H24N4O2.C26H22N4O2.C25H22N4O3.C25H20N4O2.C25H22N4O2/c1-30(19-5-3-2-4-6-19)20-9-10-22-25(15-20)29-31(16-17-7-8-17)26(22)18-13-23-21(27(32)33)11-12-28-24(23)14-18;1-29-25(17-13-21-19(26(31)32)10-11-27-22(21)14-17)20-9-8-18(15-23(20)28-29)30-12-4-6-16-5-2-3-7-24(16)30;1-28(17-5-3-2-4-6-17)18-7-8-20-23(15-18)27-29(11-12-30)24(20)16-13-21-19(25(31)32)9-10-26-22(21)14-16;1-28-24(16-12-20-18(25(30)31)8-10-26-21(20)13-16)19-7-6-17(14-22(19)27-28)29-11-9-15-4-2-3-5-23(15)29;1-3-29(17-7-5-4-6-8-17)18-9-10-20-23(15-18)27-28(2)24(20)16-13-21-19(25(30)31)11-12-26-22(21)14-16/h2-6,9-12,14-15,17H,7-8,13,16H2,1H3,(H,32,33);2-3,5,7-11,14-15H,4,6,12-13H2,1H3,(H,31,32);2-10,14-15,30H,11-13H2,1H3,(H,31,32);2-8,10,13-14H,9,11-12H2,1H3,(H,30,31);4-12,14-15H,3,13H2,1-2H3,(H,30,31)
InChIKeyNQSKUIQOJLPZOQ-UHFFFAOYSA-N
XLogP23.62
TPSA376.48 Ų
H-Bond Donors6
H-Bond Acceptors26
Rotatable Bonds23
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002104.42
LogP ≤ 523.62
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1026

Analyze 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

6-[6-(4-cyclopropyl-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 148701691
6-[6-(4-fluoro-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 147946937
6-[6-(4-methoxy-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 148917605
6-[7-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 160641045
6-[2-methyl-6-(2-methylphenoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 149046872
6-[6-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 149026987
6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 146894540
2-[6-(N-ethylanilino)-2-methylindazol-3-yl]-1H-pyrrolo[3,2-b]pyridine-7-carboxylic acid
CID 137014390
4-(3,4-dihydro-2H-quinolin-1-yl)-2-methylbenzoic acid
CID 62136292
4-(2,3-dihydroindol-1-yl)-N-ethyl-N-(3-methylphenyl)pyrimidin-2-amine
CID 112902262
2-(3,4-dihydro-2H-quinolin-1-yl)-N,N-diethylpyrimidine-5-carboxamide
CID 109262360
4-(3,4-dihydro-2H-quinolin-1-yl)-2-ethoxyaniline
CID 63670067

Frequently Asked Questions

What is the IUPAC name of 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The IUPAC name of 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (CID 159857580) is 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is CCN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(C)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CC3CC3)nc2c1.CN(c1ccccc1)c1ccc2c(C3=Cc4nccc(C(=O)O)c4C3)n(CCO)nc2c1.Cn1nc2cc(N3CCCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1.Cn1nc2cc(N3CCc4ccccc43)ccc2c1C1=Cc2nccc(C(=O)O)c2C1.
What is the InChIKey of 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The InChIKey is NQSKUIQOJLPZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N4O2.C26H22N4O2.C25H22N4O3.C25H20N4O2.C25H22N4O2/c1-30(19-5-3-2-4-6-19)20-9-10-22-25(15-20)29-31(16-17-7-8-17)26(22)18-13-23-21(27(32)33)11-12-28-24(23)14-18;1-29-25(17-13-21-19(26(31)32)10-11-27-22(21)14-17)20-9-8-18(15-23(20)28-29)30-12-4-6-16-5-2-3-7-24(16)30;1-28(17-5-3-2-4-6-17)18-7-8-20-23(15-18)27-29(11-12-30)24(20)16-13-21-19(25(31)32)9-10-26-22(21)14-16;1-28-24(16-12-20-18(25(30)31)8-10-26-21(20)13-16)19-7-6-17(14-22(19)27-28)29-11-9-15-4-2-3-5-23(15)29;1-3-29(17-7-5-4-6-8-17)18-9-10-20-23(15-18)27-28(2)24(20)16-13-21-19(25(30)31)11-12-26-22(21)14-16/h2-6,9-12,14-15,17H,7-8,13,16H2,1H3,(H,32,33);2-3,5,7-11,14-15H,4,6,12-13H2,1H3,(H,31,32);2-10,14-15,30H,11-13H2,1H3,(H,31,32);2-8,10,13-14H,9,11-12H2,1H3,(H,30,31);4-12,14-15H,3,13H2,1-2H3,(H,30,31).
What are the key properties of 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid has a molecular weight of 2104.42 g/mol, XLogP of 23.62, 23 rotatable bonds, 6 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(cyclopropylmethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(2,3-dihydroindol-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[6-(N-ethylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-(2-hydroxyethyl)-6-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is sourced from PubChem (CID 159857580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).