[5-(indazol-1-ylmethyl)furan-2-yl]methanol

C13H12N2O2 — CID 113372439

IUPAC[5-(indazol-1-ylmethyl)furan-2-yl]methanol
SMILESOCc1ccc(Cn2ncc3ccccc32)o1
InChIInChI=1S/C13H12N2O2/c16-9-12-6-5-11(17-12)8-15-13-4-2-1-3-10(13)7-14-15/h1-7,16H,8-9H2
InChIKeySMFJETCWVDOKRV-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.17
Rot. Bonds3

About [5-(indazol-1-ylmethyl)furan-2-yl]methanol

[5-(indazol-1-ylmethyl)furan-2-yl]methanol (PubChem CID 113372439) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is [5-(indazol-1-ylmethyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(indazol-1-ylmethyl)furan-2-yl]methanol
PubChem CID113372439
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name[5-(indazol-1-ylmethyl)furan-2-yl]methanol
SMILESOCc1ccc(Cn2ncc3ccccc32)o1
InChIInChI=1S/C13H12N2O2/c16-9-12-6-5-11(17-12)8-15-13-4-2-1-3-10(13)7-14-15/h1-7,16H,8-9H2
InChIKeySMFJETCWVDOKRV-UHFFFAOYSA-N
XLogP2.17
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(indazol-1-ylmethyl)furan-2-carbohydrazide
CID 63578154
5-(indazol-1-ylmethyl)furan-3-carboxylic acid
CID 62267281
4-indazol-1-ylbutan-1-ol
CID 62142094
5-(indazol-1-ylmethyl)-2-methylfuran-3-carbohydrazide
CID 63578155
2-amino-6-(indazol-1-ylmethyl)benzoic acid
CID 104824957
3-indazol-1-ylpropanoic acid
CID 805922
cobalt;1-ethylindazole
CID 58657391
1-ethylindazole;propane
CID 143188130
1-(4-chlorobutyl)indazole
CID 62140548
3-indazol-1-ylpropanoate
CID 5147223
N-[[5-(indazol-1-ylmethyl)thiophen-2-yl]methyl]ethanamine
CID 107557716
4-[2-(indazol-1-ylmethyl)phenyl]but-3-yn-1-ol
CID 62141899

Frequently Asked Questions

What is the IUPAC name of [5-(indazol-1-ylmethyl)furan-2-yl]methanol?
The IUPAC name of [5-(indazol-1-ylmethyl)furan-2-yl]methanol (CID 113372439) is [5-(indazol-1-ylmethyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(indazol-1-ylmethyl)furan-2-yl]methanol?
The canonical SMILES for [5-(indazol-1-ylmethyl)furan-2-yl]methanol is OCc1ccc(Cn2ncc3ccccc32)o1.
What is the InChIKey of [5-(indazol-1-ylmethyl)furan-2-yl]methanol?
The InChIKey is SMFJETCWVDOKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c16-9-12-6-5-11(17-12)8-15-13-4-2-1-3-10(13)7-14-15/h1-7,16H,8-9H2.
What are the key properties of [5-(indazol-1-ylmethyl)furan-2-yl]methanol?
[5-(indazol-1-ylmethyl)furan-2-yl]methanol has a molecular weight of 228.25 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(indazol-1-ylmethyl)furan-2-yl]methanol is sourced from PubChem (CID 113372439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).