3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide

C17H19N3O3 — CID 11958697

IUPAC3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CC
InChIInChI=1S/C17H19N3O3/c1-3-20-17(22-4-2)14-8-7-12(10-15(14)19-20)16(21)18-11-13-6-5-9-23-13/h5-10H,3-4,11H2,1-2H3,(H,18,21)
InChIKeyWNIBSLPPWDJKLF-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.98
Rot. Bonds6

About 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide

3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide (PubChem CID 11958697) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide.

Molecular Properties

Compound Name3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide
PubChem CID11958697
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CC
InChIInChI=1S/C17H19N3O3/c1-3-20-17(22-4-2)14-8-7-12(10-15(14)19-20)16(21)18-11-13-6-5-9-23-13/h5-10H,3-4,11H2,1-2H3,(H,18,21)
InChIKeyWNIBSLPPWDJKLF-UHFFFAOYSA-N
XLogP2.98
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The IUPAC name of 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide (CID 11958697) is 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide.
What is the SMILES notation for 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The canonical SMILES for 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide is CCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CC.
What is the InChIKey of 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide?
The InChIKey is WNIBSLPPWDJKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-3-20-17(22-4-2)14-8-7-12(10-15(14)19-20)16(21)18-11-13-6-5-9-23-13/h5-10H,3-4,11H2,1-2H3,(H,18,21).
What are the key properties of 3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide?
3-ethoxy-2-ethyl-N-(furan-2-ylmethyl)indazole-6-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.98, 6 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-(furan-2-ylmethyl)indazole-6-carboxamide is sourced from PubChem (CID 11958697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).