[5-(1-phenylindazol-3-yl)furan-2-yl]methanol

C18H14N2O2 — CID 10039848

IUPAC[5-(1-phenylindazol-3-yl)furan-2-yl]methanol
SMILESOCc1ccc(-c2nn(-c3ccccc3)c3ccccc23)o1
InChIInChI=1S/C18H14N2O2/c21-12-14-10-11-17(22-14)18-15-8-4-5-9-16(15)20(19-18)13-6-2-1-3-7-13/h1-11,21H,12H2
InChIKeyNWEZIGFGYORHCZ-UHFFFAOYSA-N
MW290.32 g/mol
LogP3.78
Rot. Bonds3

About [5-(1-phenylindazol-3-yl)furan-2-yl]methanol

[5-(1-phenylindazol-3-yl)furan-2-yl]methanol (PubChem CID 10039848) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is [5-(1-phenylindazol-3-yl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(1-phenylindazol-3-yl)furan-2-yl]methanol
PubChem CID10039848
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC Name[5-(1-phenylindazol-3-yl)furan-2-yl]methanol
SMILESOCc1ccc(-c2nn(-c3ccccc3)c3ccccc23)o1
InChIInChI=1S/C18H14N2O2/c21-12-14-10-11-17(22-14)18-15-8-4-5-9-16(15)20(19-18)13-6-2-1-3-7-13/h1-11,21H,12H2
InChIKeyNWEZIGFGYORHCZ-UHFFFAOYSA-N
XLogP3.78
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-(1-phenylindazol-3-yl)furan-2-yl]methanol?
The IUPAC name of [5-(1-phenylindazol-3-yl)furan-2-yl]methanol (CID 10039848) is [5-(1-phenylindazol-3-yl)furan-2-yl]methanol.
What is the SMILES notation for [5-(1-phenylindazol-3-yl)furan-2-yl]methanol?
The canonical SMILES for [5-(1-phenylindazol-3-yl)furan-2-yl]methanol is OCc1ccc(-c2nn(-c3ccccc3)c3ccccc23)o1.
What is the InChIKey of [5-(1-phenylindazol-3-yl)furan-2-yl]methanol?
The InChIKey is NWEZIGFGYORHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-12-14-10-11-17(22-14)18-15-8-4-5-9-16(15)20(19-18)13-6-2-1-3-7-13/h1-11,21H,12H2.
What are the key properties of [5-(1-phenylindazol-3-yl)furan-2-yl]methanol?
[5-(1-phenylindazol-3-yl)furan-2-yl]methanol has a molecular weight of 290.32 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-phenylindazol-3-yl)furan-2-yl]methanol is sourced from PubChem (CID 10039848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).