3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide

C18H21N3O2S — CID 11958436

IUPAC3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCCc3cccs3)cc2nn1CC
InChIInChI=1S/C18H21N3O2S/c1-3-21-18(23-4-2)15-8-7-13(12-16(15)20-21)17(22)19-10-9-14-6-5-11-24-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,22)
InChIKeyQQJYULUXUZLTGT-UHFFFAOYSA-N
MW343.45 g/mol
LogP3.49
Rot. Bonds7

About 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide

3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide (PubChem CID 11958436) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide.

Molecular Properties

Compound Name3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide
PubChem CID11958436
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC Name3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCCc3cccs3)cc2nn1CC
InChIInChI=1S/C18H21N3O2S/c1-3-21-18(23-4-2)15-8-7-13(12-16(15)20-21)17(22)19-10-9-14-6-5-11-24-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,22)
InChIKeyQQJYULUXUZLTGT-UHFFFAOYSA-N
XLogP3.49
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide?
The IUPAC name of 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide (CID 11958436) is 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide.
What is the SMILES notation for 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide?
The canonical SMILES for 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide is CCOc1c2ccc(C(=O)NCCc3cccs3)cc2nn1CC.
What is the InChIKey of 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide?
The InChIKey is QQJYULUXUZLTGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-3-21-18(23-4-2)15-8-7-13(12-16(15)20-21)17(22)19-10-9-14-6-5-11-24-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,19,22).
What are the key properties of 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide?
3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide has a molecular weight of 343.45 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-ethyl-N-(2-thiophen-2-ylethyl)indazole-6-carboxamide is sourced from PubChem (CID 11958436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).