4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide

C20H27BrN4O2Si — CID 140662743

IUPAC4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide
SMILESCC(C)(C)[Si](C)(C)OCCn1cc(-c2cc3c(Br)ccc(C(N)=O)c3[nH]2)cn1
InChIInChI=1S/C20H27BrN4O2Si/c1-20(2,3)28(4,5)27-9-8-25-12-13(11-23-25)17-10-15-16(21)7-6-14(19(22)26)18(15)24-17/h6-7,10-12,24H,8-9H2,1-5H3,(H2,22,26)
InChIKeyQCDJWOKQOUGRMT-UHFFFAOYSA-N
MW463.45 g/mol
LogP4.91
Rot. Bonds6

About 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide

4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide (PubChem CID 140662743) has the molecular formula C20H27BrN4O2Si and a molecular weight of 463.45 g/mol. Its IUPAC name is 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide.

Molecular Properties

Compound Name4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide
PubChem CID140662743
Molecular FormulaC20H27BrN4O2Si
Molecular Weight463.45 g/mol
Exact Mass462.11
IUPAC Name4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide
SMILESCC(C)(C)[Si](C)(C)OCCn1cc(-c2cc3c(Br)ccc(C(N)=O)c3[nH]2)cn1
InChIInChI=1S/C20H27BrN4O2Si/c1-20(2,3)28(4,5)27-9-8-25-12-13(11-23-25)17-10-15-16(21)7-6-14(19(22)26)18(15)24-17/h6-7,10-12,24H,8-9H2,1-5H3,(H2,22,26)
InChIKeyQCDJWOKQOUGRMT-UHFFFAOYSA-N
XLogP4.91
TPSA85.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.45
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide 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

4-bromo-2-(1-methylpyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridine-7-carboxamide
CID 129265147
tert-butyl-[2-(4-iodopyrazol-1-yl)ethoxy]-dimethylsilane
CID 164547420
2-(4-bromoindazol-1-yl)ethoxy-tert-butyl-dimethylsilane
CID 169069472
2-(4-bromo-3-ethylpyrazol-1-yl)ethoxy-tert-butyl-dimethylsilane
CID 171788500
N-[3-[7-carbamoyl-2-(1-methylpyrazol-4-yl)-1H-indol-4-yl]-2-methylphenyl]-N-(oxetan-3-yl)-1,3-thiazole-2-carboxamide
CID 86763130
N-[3-[7-carbamoyl-2-(1-methylpyrazol-4-yl)-1H-indol-4-yl]-2-ethylphenyl]-1,3-thiazole-2-carboxamide;N-[3-[7-carbamoyl-2-(1-methylpyrazol-4-yl)-1H-indol-4-yl]-2-(hydroxymethyl)phenyl]-1,3-thiazole-2-carboxamide
CID 160893111
ethane;2-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazolo[5,1-b][1,3]thiazole-7-carboxamide
CID 164547093
2-[4-(4-methyl-1H-indol-2-yl)pyrazol-1-yl]ethanol
CID 166849185
4-bromo-1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazole-5-carbaldehyde
CID 154722593
6-ethyl-4-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-2-carboxamide;propane
CID 170574669
4-[2-(aminomethyl)phenyl]-2-pyridin-4-yl-1H-indole-7-carboxamide;1H-azet-2-one
CID 174783807
4-[3-bromo-4-[4-[tert-butyl(dimethyl)silyl]oxybutoxy]phenyl]benzoic acid
CID 141144653

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide?
The IUPAC name of 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide (CID 140662743) is 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide.
What is the SMILES notation for 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide?
The canonical SMILES for 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide is CC(C)(C)[Si](C)(C)OCCn1cc(-c2cc3c(Br)ccc(C(N)=O)c3[nH]2)cn1.
What is the InChIKey of 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide?
The InChIKey is QCDJWOKQOUGRMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27BrN4O2Si/c1-20(2,3)28(4,5)27-9-8-25-12-13(11-23-25)17-10-15-16(21)7-6-14(19(22)26)18(15)24-17/h6-7,10-12,24H,8-9H2,1-5H3,(H2,22,26).
What are the key properties of 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide?
4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide has a molecular weight of 463.45 g/mol, XLogP of 4.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]pyrazol-4-yl]-1H-indole-7-carboxamide is sourced from PubChem (CID 140662743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).