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

C18H21N3O4 — CID 11958391

IUPAC3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CCOC
InChIInChI=1S/C18H21N3O4/c1-3-24-18-15-7-6-13(11-16(15)20-21(18)8-10-23-2)17(22)19-12-14-5-4-9-25-14/h4-7,9,11H,3,8,10,12H2,1-2H3,(H,19,22)
InChIKeyJXOIQXOMHOCFAO-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.60
Rot. Bonds8

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

3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide (PubChem CID 11958391) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide.

Molecular Properties

Compound Name3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide
PubChem CID11958391
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide
SMILESCCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CCOC
InChIInChI=1S/C18H21N3O4/c1-3-24-18-15-7-6-13(11-16(15)20-21(18)8-10-23-2)17(22)19-12-14-5-4-9-25-14/h4-7,9,11H,3,8,10,12H2,1-2H3,(H,19,22)
InChIKeyJXOIQXOMHOCFAO-UHFFFAOYSA-N
XLogP2.60
TPSA78.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide?
The IUPAC name of 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide (CID 11958391) is 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide.
What is the SMILES notation for 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide?
The canonical SMILES for 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide is CCOc1c2ccc(C(=O)NCc3ccco3)cc2nn1CCOC.
What is the InChIKey of 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide?
The InChIKey is JXOIQXOMHOCFAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-3-24-18-15-7-6-13(11-16(15)20-21(18)8-10-23-2)17(22)19-12-14-5-4-9-25-14/h4-7,9,11H,3,8,10,12H2,1-2H3,(H,19,22).
What are the key properties of 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide?
3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 2.60, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(furan-2-ylmethyl)-2-(2-methoxyethyl)indazole-6-carboxamide is sourced from PubChem (CID 11958391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).