7-(furan-2-yl)-3-iodo-2H-indazole

C11H7IN2O — CID 168527750

IUPAC7-(furan-2-yl)-3-iodo-2H-indazole
SMILESIc1[nH]nc2c(-c3ccco3)cccc12
InChIInChI=1S/C11H7IN2O/c12-11-8-4-1-3-7(10(8)13-14-11)9-5-2-6-15-9/h1-6H,(H,13,14)
InChIKeyGZPVWOAVAQGIKJ-UHFFFAOYSA-N
MW310.09 g/mol
LogP3.43
Rot. Bonds1

About 7-(furan-2-yl)-3-iodo-2H-indazole

7-(furan-2-yl)-3-iodo-2H-indazole (PubChem CID 168527750) has the molecular formula C11H7IN2O and a molecular weight of 310.09 g/mol. Its IUPAC name is 7-(furan-2-yl)-3-iodo-2H-indazole.

Molecular Properties

Compound Name7-(furan-2-yl)-3-iodo-2H-indazole
PubChem CID168527750
Molecular FormulaC11H7IN2O
Molecular Weight310.09 g/mol
Exact Mass309.96
IUPAC Name7-(furan-2-yl)-3-iodo-2H-indazole
SMILESIc1[nH]nc2c(-c3ccco3)cccc12
InChIInChI=1S/C11H7IN2O/c12-11-8-4-1-3-7(10(8)13-14-11)9-5-2-6-15-9/h1-6H,(H,13,14)
InChIKeyGZPVWOAVAQGIKJ-UHFFFAOYSA-N
XLogP3.43
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.09
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-(furan-2-yl)quinoline
CID 135387674
2-phenanthren-1-ylfuran
CID 142748745
2-[2-(furan-2-yl)phenyl]pyridine
CID 168525808
4-(furan-2-yl)-3-methyl-1H-pyridazine-6-thione
CID 139699801
5-(furan-2-yl)-2,3-dimethylphthalazine-1,4-dione
CID 168528319
2-(2-fluorophenyl)furan
CID 10511186
2-(2-chloro-3-methylphenyl)furan
CID 168528578
5-[2-(furan-2-yl)phenyl]-1,3-oxazole
CID 168525054
2-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]phenol
CID 135449034
4-chloro-7-(furan-2-yl)-1H-indazole
CID 168526868
ethane;2-(2-methylphenyl)furan
CID 142082580
5-amino-4-(furan-2-yl)-1H-pyridazin-6-one
CID 117127370

Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-3-iodo-2H-indazole?
The IUPAC name of 7-(furan-2-yl)-3-iodo-2H-indazole (CID 168527750) is 7-(furan-2-yl)-3-iodo-2H-indazole.
What is the SMILES notation for 7-(furan-2-yl)-3-iodo-2H-indazole?
The canonical SMILES for 7-(furan-2-yl)-3-iodo-2H-indazole is Ic1[nH]nc2c(-c3ccco3)cccc12.
What is the InChIKey of 7-(furan-2-yl)-3-iodo-2H-indazole?
The InChIKey is GZPVWOAVAQGIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7IN2O/c12-11-8-4-1-3-7(10(8)13-14-11)9-5-2-6-15-9/h1-6H,(H,13,14).
What are the key properties of 7-(furan-2-yl)-3-iodo-2H-indazole?
7-(furan-2-yl)-3-iodo-2H-indazole has a molecular weight of 310.09 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-3-iodo-2H-indazole is sourced from PubChem (CID 168527750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).