2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol

C23H20N2O3 — CID 135839318

IUPAC2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol
SMILESOCCOc1cc(-c2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)ccc1O
InChIInChI=1S/C23H20N2O3/c26-12-13-28-23-15-18(8-11-22(23)27)17-7-9-19-20(24-25-21(19)14-17)10-6-16-4-2-1-3-5-16/h1-11,14-15,26-27H,12-13H2,(H,24,25)/b10-6+
InChIKeyALIUOTDYIANSBJ-UXBLZVDNSA-N
MW372.42 g/mol
LogP4.48
Rot. Bonds6

About 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol

2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol (PubChem CID 135839318) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol
PubChem CID135839318
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol
SMILESOCCOc1cc(-c2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)ccc1O
InChIInChI=1S/C23H20N2O3/c26-12-13-28-23-15-18(8-11-22(23)27)17-7-9-19-20(24-25-21(19)14-17)10-6-16-4-2-1-3-5-16/h1-11,14-15,26-27H,12-13H2,(H,24,25)/b10-6+
InChIKeyALIUOTDYIANSBJ-UXBLZVDNSA-N
XLogP4.48
TPSA78.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol?
The IUPAC name of 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol (CID 135839318) is 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol.
What is the SMILES notation for 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol?
The canonical SMILES for 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol is OCCOc1cc(-c2ccc3c(/C=C/c4ccccc4)n[nH]c3c2)ccc1O.
What is the InChIKey of 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol?
The InChIKey is ALIUOTDYIANSBJ-UXBLZVDNSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-12-13-28-23-15-18(8-11-22(23)27)17-7-9-19-20(24-25-21(19)14-17)10-6-16-4-2-1-3-5-16/h1-11,14-15,26-27H,12-13H2,(H,24,25)/b10-6+.
What are the key properties of 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol?
2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol has a molecular weight of 372.42 g/mol, XLogP of 4.48, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)-4-[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]phenol is sourced from PubChem (CID 135839318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).