2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene

C20H18O2 — CID 44563763

IUPAC2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene
SMILESCOc1cc(/C=C/c2ccc3ccccc3c2)cc(OC)c1
InChIInChI=1S/C20H18O2/c1-21-19-12-16(13-20(14-19)22-2)8-7-15-9-10-17-5-3-4-6-18(17)11-15/h3-14H,1-2H3/b8-7+
InChIKeyBEWBEVSAYPCXOM-BQYQJAHWSA-N
MW290.36 g/mol
LogP5.03
Rot. Bonds4

About 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene

2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene (PubChem CID 44563763) has the molecular formula C20H18O2 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene.

Molecular Properties

Compound Name2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene
PubChem CID44563763
Molecular FormulaC20H18O2
Molecular Weight290.36 g/mol
Exact Mass290.13
IUPAC Name2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene
SMILESCOc1cc(/C=C/c2ccc3ccccc3c2)cc(OC)c1
InChIInChI=1S/C20H18O2/c1-21-19-12-16(13-20(14-19)22-2)8-7-15-9-10-17-5-3-4-6-18(17)11-15/h3-14H,1-2H3/b8-7+
InChIKeyBEWBEVSAYPCXOM-BQYQJAHWSA-N
XLogP5.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.36
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-dimethoxy-5-[2-(4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)ethenyl]benzene
CID 57369399
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
1-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-3,5-dimethoxybenzene
CID 139077239
9-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]anthracene
CID 25028120
2-methoxy-5-[(E)-2-naphthalen-2-ylethenyl]phenol
CID 11231216
2-[(Z)-2-anthracen-2-ylethenyl]anthracene
CID 101144533
6-methoxy-2-[(E)-2-naphthalen-2-ylethenyl]quinolin-8-amine
CID 10616121
6-[(Z)-2-(3,5-dimethoxyphenyl)ethenyl]-1H-indole
CID 25050334
1,3-dimethoxy-5-[2-(4-methylphenyl)ethenyl]benzene
CID 58240360
2-[2-[4-(2-tetracen-2-ylethenyl)phenyl]ethenyl]tetracene
CID 76589902
2-[(Z)-2-[3-[3,5-bis[(Z)-prop-1-enyl]phenyl]-5-[(Z)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 134888133
3-methoxy-5-(2-naphthalen-2-yloxyethenyl)phenol
CID 75952248

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene?
The IUPAC name of 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene (CID 44563763) is 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene.
What is the SMILES notation for 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene?
The canonical SMILES for 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene is COc1cc(/C=C/c2ccc3ccccc3c2)cc(OC)c1.
What is the InChIKey of 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene?
The InChIKey is BEWBEVSAYPCXOM-BQYQJAHWSA-N. The full InChI is InChI=1S/C20H18O2/c1-21-19-12-16(13-20(14-19)22-2)8-7-15-9-10-17-5-3-4-6-18(17)11-15/h3-14H,1-2H3/b8-7+.
What are the key properties of 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene?
2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene has a molecular weight of 290.36 g/mol, XLogP of 5.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]naphthalene is sourced from PubChem (CID 44563763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).