tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate

C61H85Cl2N9O14Si — CID 158415728

IUPACtert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate
SMILESCC(C)(C)[Si](C)(C)OCCOCCCl.CCCOCCn1cc(C(=O)C(=O)OC)c2ccccc21.NC(=O)Cc1[nH]nc2ccccc12.NC(=O)Cc1nn(CCOCCO)c2ccccc12.O=C(O)Cc1[nH]nc2ccccc12.OCCOCCCl
InChIInChI=1S/C16H19NO4.C13H17N3O3.C10H23ClO2Si.C9H9N3O.C9H8N2O2.C4H9ClO2/c1-3-9-21-10-8-17-11-13(15(18)16(19)20-2)12-6-4-5-7-14(12)17;14-13(18)9-11-10-3-1-2-4-12(10)16(15-11)5-7-19-8-6-17;1-10(2,3)14(4,5)13-9-8-12-7-6-11;10-9(13)5-8-6-3-1-2-4-7(6)11-12-8;12-9(13)5-8-6-3-1-2-4-7(6)10-11-8;5-1-3-7-4-2-6/h4-7,11H,3,8-10H2,1-2H3;1-4,17H,5-9H2,(H2,14,18);6-9H2,1-5H3;1-4H,5H2,(H2,10,13)(H,11,12);1-4H,5H2,(H,10,11)(H,12,13);6H,1-4H2
InChIKeyGZWIETBTFVKFIJ-UHFFFAOYSA-N
MW1267.39 g/mol
LogP7.78
Rot. Bonds28

About tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate

tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate (PubChem CID 158415728) has the molecular formula C61H85Cl2N9O14Si and a molecular weight of 1267.39 g/mol. Its IUPAC name is tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate.

Molecular Properties

Compound Nametert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate
PubChem CID158415728
Molecular FormulaC61H85Cl2N9O14Si
Molecular Weight1267.39 g/mol
Exact Mass1265.54
IUPAC Nametert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate
SMILESCC(C)(C)[Si](C)(C)OCCOCCCl.CCCOCCn1cc(C(=O)C(=O)OC)c2ccccc21.NC(=O)Cc1[nH]nc2ccccc12.NC(=O)Cc1nn(CCOCCO)c2ccccc12.O=C(O)Cc1[nH]nc2ccccc12.OCCOCCCl
InChIInChI=1S/C16H19NO4.C13H17N3O3.C10H23ClO2Si.C9H9N3O.C9H8N2O2.C4H9ClO2/c1-3-9-21-10-8-17-11-13(15(18)16(19)20-2)12-6-4-5-7-14(12)17;14-13(18)9-11-10-3-1-2-4-12(10)16(15-11)5-7-19-8-6-17;1-10(2,3)14(4,5)13-9-8-12-7-6-11;10-9(13)5-8-6-3-1-2-4-7(6)11-12-8;12-9(13)5-8-6-3-1-2-4-7(6)10-11-8;5-1-3-7-4-2-6/h4-7,11H,3,8-10H2,1-2H3;1-4,17H,5-9H2,(H2,14,18);6-9H2,1-5H3;1-4H,5H2,(H2,10,13)(H,11,12);1-4H,5H2,(H,10,11)(H,12,13);6H,1-4H2
InChIKeyGZWIETBTFVKFIJ-UHFFFAOYSA-N
XLogP7.78
TPSA333.57 Ų
H-Bond Donors7
H-Bond Acceptors18
Rotatable Bonds28
Heavy Atoms87
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001267.39
LogP ≤ 57.78
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate 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

3-Bromopropoxy-tert-butyl-dimethylsilane;2-[1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]indazol-3-yl]acetamide;3-[1-(3-hydroxypropyl)indazol-3-yl]-4-(1-naphthalen-2-ylindol-3-yl)pyrrole-2,5-dione;methyl 2-(1-naphthalen-2-ylindol-3-yl)-2-oxoacetate
CID 157769437
azane;3-bromopropoxy-tert-butyl-dimethylsilane;2-[1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]indazol-3-yl]acetamide;3-[1-(3-hydroxypropyl)indol-3-yl]-4-phenylpyrrole-2,5-dione;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-phenylacetate;hydrate
CID 158235468
3-Bromopropoxy-tert-butyl-dimethylsilane;2-[2-(2-chloroethoxy)ethoxy]ethanol;3-[1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]indol-3-yl]-4-[1-(3-hydroxypropyl)indol-3-yl]pyrrole-2,5-dione;2-[1-[2-(2-hydroxyethoxy)ethoxymethyl]indol-3-yl]acetamide;methyl 2-[1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]indazol-3-yl]-2-oxoacetate
CID 158326080
3-Bromopropoxy-tert-butyl-dimethylsilane;2-[1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]indazol-3-yl]acetamide;3-[1-(3-hydroxypropyl)indazol-3-yl]-4-(1-naphthalen-2-ylindol-3-yl)pyrrole-2,5-dione;methane;methyl 2-(1-naphthalen-2-ylindol-3-yl)-2-oxoacetate
CID 161311309
butane;tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;3-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]-4-[1-[2-(2-hydroxyethoxy)ethyl]indol-3-yl]pyrrole-2,5-dione;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methanamine;methane;methyl 2-[1-[2-[2-[[deuterio(tritio)boranyl]methylsulfanyloxy]ethoxy]ethyl]indol-3-yl]-2-oxoacetate;20-methyl-17,23-dioxa-4,14,20,26,33-pentazahexacyclo[24.6.1.17,14.02,6.08,13.027,32]tetratriaconta-1(33),2(6),7(34),8,10,12,27,29,31-nonaene-3,5-dione;2-[2-[3-[4-[1-[2-(2-methylsulfonyloxyethoxy)ethyl]indazol-3-yl]-2,5-dioxopyrrol-3-yl]indol-1-yl]ethoxy]ethyl methanesulfonate;oxolane;propane
CID 161462667

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate?
The IUPAC name of tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate (CID 158415728) is tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate.
What is the SMILES notation for tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate?
The canonical SMILES for tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate is CC(C)(C)[Si](C)(C)OCCOCCCl.CCCOCCn1cc(C(=O)C(=O)OC)c2ccccc21.NC(=O)Cc1[nH]nc2ccccc12.NC(=O)Cc1nn(CCOCCO)c2ccccc12.O=C(O)Cc1[nH]nc2ccccc12.OCCOCCCl.
What is the InChIKey of tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate?
The InChIKey is GZWIETBTFVKFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO4.C13H17N3O3.C10H23ClO2Si.C9H9N3O.C9H8N2O2.C4H9ClO2/c1-3-9-21-10-8-17-11-13(15(18)16(19)20-2)12-6-4-5-7-14(12)17;14-13(18)9-11-10-3-1-2-4-12(10)16(15-11)5-7-19-8-6-17;1-10(2,3)14(4,5)13-9-8-12-7-6-11;10-9(13)5-8-6-3-1-2-4-7(6)11-12-8;12-9(13)5-8-6-3-1-2-4-7(6)10-11-8;5-1-3-7-4-2-6/h4-7,11H,3,8-10H2,1-2H3;1-4,17H,5-9H2,(H2,14,18);6-9H2,1-5H3;1-4H,5H2,(H2,10,13)(H,11,12);1-4H,5H2,(H,10,11)(H,12,13);6H,1-4H2.
What are the key properties of tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate?
tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate has a molecular weight of 1267.39 g/mol, XLogP of 7.78, 28 rotatable bonds, 7 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(2-chloroethoxy)ethoxy]-dimethylsilane;2-(2-chloroethoxy)ethanol;2-[1-[2-(2-hydroxyethoxy)ethyl]indazol-3-yl]acetamide;2-(2H-indazol-3-yl)acetamide;2-(2H-indazol-3-yl)acetic acid;methyl 2-oxo-2-[1-(2-propoxyethyl)indol-3-yl]acetate is sourced from PubChem (CID 158415728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).