1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol

C18H20O4 — CID 147108243

IUPAC1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol
SMILESC=CC(O)(c1ccc(OC)cc1)c1ccc(OCCO)cc1
InChIInChI=1S/C18H20O4/c1-3-18(20,14-4-8-16(21-2)9-5-14)15-6-10-17(11-7-15)22-13-12-19/h3-11,19-20H,1,12-13H2,2H3
InChIKeyBLZKIGGLSSYDBD-UHFFFAOYSA-N
MW300.35 g/mol
LogP2.49
Rot. Bonds7

About 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol

1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol (PubChem CID 147108243) has the molecular formula C18H20O4 and a molecular weight of 300.35 g/mol. Its IUPAC name is 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol
PubChem CID147108243
Molecular FormulaC18H20O4
Molecular Weight300.35 g/mol
Exact Mass300.14
IUPAC Name1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol
SMILESC=CC(O)(c1ccc(OC)cc1)c1ccc(OCCO)cc1
InChIInChI=1S/C18H20O4/c1-3-18(20,14-4-8-16(21-2)9-5-14)15-6-10-17(11-7-15)22-13-12-19/h3-11,19-20H,1,12-13H2,2H3
InChIKeyBLZKIGGLSSYDBD-UHFFFAOYSA-N
XLogP2.49
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol
CID 117300551
[4-(2-hydroxyethoxy)phenyl]-(4-methoxyphenyl)methanone
CID 66778395
CID 162335780
CID 162335780
4-(4-methoxyphenoxy)-2-methylbutan-2-ol
CID 79361726
6-[4-[hydroxy-bis(4-methoxyphenyl)methyl]phenoxy]-N-methylhexanamide
CID 22886581
2-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethanol
CID 14533806
2-[2-[4-[2-[4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethoxy]ethanol
CID 15607829
2-[4-[1-(4-methoxyphenyl)cyclohexyl]phenoxy]ethanol
CID 90294446
(4-methoxyphenoxy)methanol
CID 20580272
(4-ethenylphenyl)-bis(4-methoxyphenyl)methanol
CID 101342310
2-[4-(4-methoxyphenyl)phenoxy]ethyl prop-2-enoate
CID 59181081
ethane;2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanol;hydrate
CID 144516438

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol?
The IUPAC name of 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol (CID 147108243) is 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol.
What is the SMILES notation for 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol?
The canonical SMILES for 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol is C=CC(O)(c1ccc(OC)cc1)c1ccc(OCCO)cc1.
What is the InChIKey of 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol?
The InChIKey is BLZKIGGLSSYDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O4/c1-3-18(20,14-4-8-16(21-2)9-5-14)15-6-10-17(11-7-15)22-13-12-19/h3-11,19-20H,1,12-13H2,2H3.
What are the key properties of 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol?
1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol has a molecular weight of 300.35 g/mol, XLogP of 2.49, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol is sourced from PubChem (CID 147108243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).