2-(4-phthalazin-1-yloxyphenyl)ethanol

C16H14N2O2 — CID 107709669

IUPAC2-(4-phthalazin-1-yloxyphenyl)ethanol
SMILESOCCc1ccc(Oc2nncc3ccccc23)cc1
InChIInChI=1S/C16H14N2O2/c19-10-9-12-5-7-14(8-6-12)20-16-15-4-2-1-3-13(15)11-17-18-16/h1-8,11,19H,9-10H2
InChIKeyLZJZUGWDRQGXSF-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.96
Rot. Bonds4

About 2-(4-phthalazin-1-yloxyphenyl)ethanol

2-(4-phthalazin-1-yloxyphenyl)ethanol (PubChem CID 107709669) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(4-phthalazin-1-yloxyphenyl)ethanol.

Molecular Properties

Compound Name2-(4-phthalazin-1-yloxyphenyl)ethanol
PubChem CID107709669
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(4-phthalazin-1-yloxyphenyl)ethanol
SMILESOCCc1ccc(Oc2nncc3ccccc23)cc1
InChIInChI=1S/C16H14N2O2/c19-10-9-12-5-7-14(8-6-12)20-16-15-4-2-1-3-13(15)11-17-18-16/h1-8,11,19H,9-10H2
InChIKeyLZJZUGWDRQGXSF-UHFFFAOYSA-N
XLogP2.96
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-phthalazin-1-yloxyphenyl)methanol
CID 112724620
1-(4-bromo-3-methylphenoxy)phthalazine
CID 83141017
2-oxopropanedial;tetrakis(1-phthalazin-1-yloxyphthalazine)
CID 174500903
2-methyl-4-phthalazin-1-yloxybenzoic acid
CID 107672665
N-(3-phthalazin-1-yloxyphenyl)acetamide
CID 6410691
2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol
CID 107709613
CID 154026431
CID 154026431
1-[(4-fluorophenyl)methoxy]phthalazine
CID 78767267
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
CID 107709590
2-[4-(5-chloro-2-methoxypyrimidin-4-yl)oxyphenyl]ethanol
CID 107709676
2-[4-[(5-bromo-3-methyl-2-pyridinyl)oxy]phenyl]ethanol
CID 107709601
phthalazin-1-yl methanesulfonate
CID 173162760

Frequently Asked Questions

What is the IUPAC name of 2-(4-phthalazin-1-yloxyphenyl)ethanol?
The IUPAC name of 2-(4-phthalazin-1-yloxyphenyl)ethanol (CID 107709669) is 2-(4-phthalazin-1-yloxyphenyl)ethanol.
What is the SMILES notation for 2-(4-phthalazin-1-yloxyphenyl)ethanol?
The canonical SMILES for 2-(4-phthalazin-1-yloxyphenyl)ethanol is OCCc1ccc(Oc2nncc3ccccc23)cc1.
What is the InChIKey of 2-(4-phthalazin-1-yloxyphenyl)ethanol?
The InChIKey is LZJZUGWDRQGXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c19-10-9-12-5-7-14(8-6-12)20-16-15-4-2-1-3-13(15)11-17-18-16/h1-8,11,19H,9-10H2.
What are the key properties of 2-(4-phthalazin-1-yloxyphenyl)ethanol?
2-(4-phthalazin-1-yloxyphenyl)ethanol has a molecular weight of 266.30 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phthalazin-1-yloxyphenyl)ethanol is sourced from PubChem (CID 107709669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).