2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid

C44H50N10O6Si2 — CID 160787664

IUPAC2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
SMILESC[Si](C)(C)CCOCn1cc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc2n1.C[Si](C)(C)CCOCn1ncc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc21
InChIInChI=1S/2C22H25N5O3Si/c1-31(2,3)11-10-30-15-26-14-18-5-4-16(12-19(18)25-26)20-7-9-24-27(20)21-13-17(22(28)29)6-8-23-21;1-31(2,3)11-10-30-15-26-20-12-16(4-5-18(20)14-25-26)19-7-9-24-27(19)21-13-17(22(28)29)6-8-23-21/h2*4-9,12-14H,10-11,15H2,1-3H3,(H,28,29)
InChIKeySBKOYXQBDUBXIS-UHFFFAOYSA-N
MW871.12 g/mol
LogP8.59
Rot. Bonds16

About 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid

2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid (PubChem CID 160787664) has the molecular formula C44H50N10O6Si2 and a molecular weight of 871.12 g/mol. Its IUPAC name is 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
PubChem CID160787664
Molecular FormulaC44H50N10O6Si2
Molecular Weight871.12 g/mol
Exact Mass870.35
IUPAC Name2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
SMILESC[Si](C)(C)CCOCn1cc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc2n1.C[Si](C)(C)CCOCn1ncc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc21
InChIInChI=1S/2C22H25N5O3Si/c1-31(2,3)11-10-30-15-26-14-18-5-4-16(12-19(18)25-26)20-7-9-24-27(20)21-13-17(22(28)29)6-8-23-21;1-31(2,3)11-10-30-15-26-20-12-16(4-5-18(20)14-25-26)19-7-9-24-27(19)21-13-17(22(28)29)6-8-23-21/h2*4-9,12-14H,10-11,15H2,1-3H3,(H,28,29)
InChIKeySBKOYXQBDUBXIS-UHFFFAOYSA-N
XLogP8.59
TPSA190.12 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms62
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500871.12
LogP ≤ 58.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6-Tert-butyl-1-methylindazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxylic acid
CID 71279500
4-(2-methyl-2H-indazol-6-yl)-7-{[2-(trimethylsilyl)ethoxy]methyl}-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid
CID 89629949
Methyl 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylate
CID 90205318
2-[5-[1-(2-Trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
CID 90210974
2-[5-[2-(2-Trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
CID 90211025
Methyl 2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylate
CID 90211074
2-(6-Ethyl-1-methylindazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxylic acid
CID 140261892
(2S)-butan-2-amine;N-[(2S)-butan-2-yl]-2-(6-fluoro-1-methylindazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide;2-(6-fluoro-1-methylindazol-3-yl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxylic acid
CID 157102612
Methyl 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylate
CID 157176262
2-[1-(1-Benzhydrylazetidin-3-yl)-6-fluoroindazol-3-yl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carbaldehyde;2-[1-(1-benzhydrylazetidin-3-yl)-6-fluoroindazol-3-yl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxylic acid
CID 157216615
2-[5-[2-(2-Trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carbonitrile;2-[5-[1-(2-trimethylsilylethoxymethyl)indol-6-yl]pyrazol-1-yl]pyridine-4-carbonitrile
CID 157571588
2-[5-[2-(2-trimethylsilylethoxymethyl)-3aH-indazol-2-ium-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid
CID 157615015

Frequently Asked Questions

What is the IUPAC name of 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid?
The IUPAC name of 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid (CID 160787664) is 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid?
The canonical SMILES for 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid is C[Si](C)(C)CCOCn1cc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc2n1.C[Si](C)(C)CCOCn1ncc2ccc(-c3ccnn3-c3cc(C(=O)O)ccn3)cc21.
What is the InChIKey of 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid?
The InChIKey is SBKOYXQBDUBXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H25N5O3Si/c1-31(2,3)11-10-30-15-26-14-18-5-4-16(12-19(18)25-26)20-7-9-24-27(20)21-13-17(22(28)29)6-8-23-21;1-31(2,3)11-10-30-15-26-20-12-16(4-5-18(20)14-25-26)19-7-9-24-27(19)21-13-17(22(28)29)6-8-23-21/h2*4-9,12-14H,10-11,15H2,1-3H3,(H,28,29).
What are the key properties of 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid?
2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid has a molecular weight of 871.12 g/mol, XLogP of 8.59, 16 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[1-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid;2-[5-[2-(2-trimethylsilylethoxymethyl)indazol-6-yl]pyrazol-1-yl]pyridine-4-carboxylic acid is sourced from PubChem (CID 160787664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).