1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol

C19H16O2 — CID 57387489

IUPAC1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol
SMILESCOc1cccc(/C=C/c2c(O)ccc3ccccc23)c1
InChIInChI=1S/C19H16O2/c1-21-16-7-4-5-14(13-16)9-11-18-17-8-3-2-6-15(17)10-12-19(18)20/h2-13,20H,1H3/b11-9+
InChIKeySGABYEIKZHOISK-PKNBQFBNSA-N
MW276.34 g/mol
LogP4.72
Rot. Bonds3

About 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol

1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol (PubChem CID 57387489) has the molecular formula C19H16O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol
PubChem CID57387489
Molecular FormulaC19H16O2
Molecular Weight276.34 g/mol
Exact Mass276.12
IUPAC Name1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol
SMILESCOc1cccc(/C=C/c2c(O)ccc3ccccc23)c1
InChIInChI=1S/C19H16O2/c1-21-16-7-4-5-14(13-16)9-11-18-17-8-3-2-6-15(17)10-12-19(18)20/h2-13,20H,1H3/b11-9+
InChIKeySGABYEIKZHOISK-PKNBQFBNSA-N
XLogP4.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(Z)-2-(3-methoxyphenyl)ethenyl]naphthalene-2-carbaldehyde
CID 165389450
5-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]benzene-1,3-diol
CID 44516242
3-[(E)-2-(3-methoxyphenyl)ethenyl]phenol
CID 11401879
9-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]anthracene
CID 25028120
3,5-dichloro-4-[(Z)-2-(3-methoxyphenyl)ethenyl]phenol
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1-[(E)-but-1-enyl]-3-methoxybenzene
CID 5382989
(E)-4-(2-hydroxynaphthalen-1-yl)but-3-en-2-one
CID 14509487
N-[3-[(E)-2-(2-hydroxynaphthalen-1-yl)ethenyl]phenyl]-2-phenylpropanamide
CID 172539215
[3-[(E)-2-[1-[2-[(E)-2-[3-(4-methoxybenzoyl)oxyphenyl]ethenyl]naphthalen-1-yl]naphthalen-2-yl]ethenyl]phenyl] 4-methoxybenzoate
CID 162498616
N'-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-N-(3-methoxyphenyl)oxamide
CID 135606654
N'-[(2-hydroxynaphthalen-1-yl)methylideneamino]-N-(3-methoxyphenyl)oxamide
CID 4584906
(E)-6-(3-methoxyphenyl)hex-5-en-3-one
CID 71490780

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol?
The IUPAC name of 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol (CID 57387489) is 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol?
The canonical SMILES for 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol is COc1cccc(/C=C/c2c(O)ccc3ccccc23)c1.
What is the InChIKey of 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol?
The InChIKey is SGABYEIKZHOISK-PKNBQFBNSA-N. The full InChI is InChI=1S/C19H16O2/c1-21-16-7-4-5-14(13-16)9-11-18-17-8-3-2-6-15(17)10-12-19(18)20/h2-13,20H,1H3/b11-9+.
What are the key properties of 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol?
1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol has a molecular weight of 276.34 g/mol, XLogP of 4.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(3-methoxyphenyl)ethenyl]naphthalen-2-ol is sourced from PubChem (CID 57387489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).