3-(furan-3-yl)-1H-indazole-5-carboxamide

C12H9N3O2 — CID 22479981

IUPAC3-(furan-3-yl)-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3ccoc3)c2c1
InChIInChI=1S/C12H9N3O2/c13-12(16)7-1-2-10-9(5-7)11(15-14-10)8-3-4-17-6-8/h1-6H,(H2,13,16)(H,14,15)
InChIKeyKZZVTCIAVLPTSO-UHFFFAOYSA-N
MW227.22 g/mol
LogP1.92
Rot. Bonds2

About 3-(furan-3-yl)-1H-indazole-5-carboxamide

3-(furan-3-yl)-1H-indazole-5-carboxamide (PubChem CID 22479981) has the molecular formula C12H9N3O2 and a molecular weight of 227.22 g/mol. Its IUPAC name is 3-(furan-3-yl)-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-(furan-3-yl)-1H-indazole-5-carboxamide
PubChem CID22479981
Molecular FormulaC12H9N3O2
Molecular Weight227.22 g/mol
Exact Mass227.07
IUPAC Name3-(furan-3-yl)-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3ccoc3)c2c1
InChIInChI=1S/C12H9N3O2/c13-12(16)7-1-2-10-9(5-7)11(15-14-10)8-3-4-17-6-8/h1-6H,(H2,13,16)(H,14,15)
InChIKeyKZZVTCIAVLPTSO-UHFFFAOYSA-N
XLogP1.92
TPSA84.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)-1H-indazole-5-carboxamide?
The IUPAC name of 3-(furan-3-yl)-1H-indazole-5-carboxamide (CID 22479981) is 3-(furan-3-yl)-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-(furan-3-yl)-1H-indazole-5-carboxamide?
The canonical SMILES for 3-(furan-3-yl)-1H-indazole-5-carboxamide is NC(=O)c1ccc2[nH]nc(-c3ccoc3)c2c1.
What is the InChIKey of 3-(furan-3-yl)-1H-indazole-5-carboxamide?
The InChIKey is KZZVTCIAVLPTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O2/c13-12(16)7-1-2-10-9(5-7)11(15-14-10)8-3-4-17-6-8/h1-6H,(H2,13,16)(H,14,15).
What are the key properties of 3-(furan-3-yl)-1H-indazole-5-carboxamide?
3-(furan-3-yl)-1H-indazole-5-carboxamide has a molecular weight of 227.22 g/mol, XLogP of 1.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-1H-indazole-5-carboxamide is sourced from PubChem (CID 22479981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).