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

C11H8N2O — CID 53408145

IUPAC5-(furan-3-yl)-1H-indazole
SMILESc1cc(-c2ccc3[nH]ncc3c2)co1
InChIInChI=1S/C11H8N2O/c1-2-11-10(6-12-13-11)5-8(1)9-3-4-14-7-9/h1-7H,(H,12,13)
InChIKeyDFKQMHNYJYMOCK-UHFFFAOYSA-N
MW184.20 g/mol
LogP2.82
Rot. Bonds1

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

5-(furan-3-yl)-1H-indazole (PubChem CID 53408145) has the molecular formula C11H8N2O and a molecular weight of 184.20 g/mol. Its IUPAC name is 5-(furan-3-yl)-1H-indazole.

Molecular Properties

Compound Name5-(furan-3-yl)-1H-indazole
PubChem CID53408145
Molecular FormulaC11H8N2O
Molecular Weight184.20 g/mol
Exact Mass184.06
IUPAC Name5-(furan-3-yl)-1H-indazole
SMILESc1cc(-c2ccc3[nH]ncc3c2)co1
InChIInChI=1S/C11H8N2O/c1-2-11-10(6-12-13-11)5-8(1)9-3-4-14-7-9/h1-7H,(H,12,13)
InChIKeyDFKQMHNYJYMOCK-UHFFFAOYSA-N
XLogP2.82
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-3-yl)-1H-indazole?
The IUPAC name of 5-(furan-3-yl)-1H-indazole (CID 53408145) is 5-(furan-3-yl)-1H-indazole.
What is the SMILES notation for 5-(furan-3-yl)-1H-indazole?
The canonical SMILES for 5-(furan-3-yl)-1H-indazole is c1cc(-c2ccc3[nH]ncc3c2)co1.
What is the InChIKey of 5-(furan-3-yl)-1H-indazole?
The InChIKey is DFKQMHNYJYMOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O/c1-2-11-10(6-12-13-11)5-8(1)9-3-4-14-7-9/h1-7H,(H,12,13).
What are the key properties of 5-(furan-3-yl)-1H-indazole?
5-(furan-3-yl)-1H-indazole has a molecular weight of 184.20 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-3-yl)-1H-indazole is sourced from PubChem (CID 53408145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).