3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol

C20H18O2 — CID 138978939

IUPAC3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol
SMILESC=CCc1c(O)c(OC)cc2ccc(-c3ccccc3)cc12
InChIInChI=1S/C20H18O2/c1-3-7-17-18-12-15(14-8-5-4-6-9-14)10-11-16(18)13-19(22-2)20(17)21/h3-6,8-13,21H,1,7H2,2H3
InChIKeyVRXQVJYLEBOPID-UHFFFAOYSA-N
MW290.36 g/mol
LogP4.95
Rot. Bonds4

About 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol

3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol (PubChem CID 138978939) has the molecular formula C20H18O2 and a molecular weight of 290.36 g/mol. Its IUPAC name is 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol.

Molecular Properties

Compound Name3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol
PubChem CID138978939
Molecular FormulaC20H18O2
Molecular Weight290.36 g/mol
Exact Mass290.13
IUPAC Name3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol
SMILESC=CCc1c(O)c(OC)cc2ccc(-c3ccccc3)cc12
InChIInChI=1S/C20H18O2/c1-3-7-17-18-12-15(14-8-5-4-6-9-14)10-11-16(18)13-19(22-2)20(17)21/h3-6,8-13,21H,1,7H2,2H3
InChIKeyVRXQVJYLEBOPID-UHFFFAOYSA-N
XLogP4.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-1-prop-2-enylnaphthalen-2-ol
CID 130034062
7-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dimethoxynaphthalen-2-ol
CID 132990589
3-hydroxy-2-methoxy-4-prop-2-enylxanthen-9-one
CID 172638269
CID 87886095
CID 87886095
1-prop-2-enylanthracen-2-ol
CID 175294805
1,3-dimethoxy-2-prop-2-enylbenzene
CID 3014232
4,5-dimethyl-2-phenyl-3-prop-2-enylphenol
CID 174558136
3-benzyl-1-prop-2-enylnaphthalen-2-ol
CID 164665597
2-ethyl-3-methoxynaphthalen-1-ol
CID 14616011
2-(4-methoxyphenyl)-6-phenyl-3,5-bis(prop-2-enyl)furo[2,3-b]pyridine
CID 102230929
3-bromo-4-methoxy-2-prop-2-enylnaphthalen-1-ol
CID 56955003
4-(4-methoxyphenyl)-2-prop-2-enylphenol
CID 54757995

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol?
The IUPAC name of 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol (CID 138978939) is 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol.
What is the SMILES notation for 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol?
The canonical SMILES for 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol is C=CCc1c(O)c(OC)cc2ccc(-c3ccccc3)cc12.
What is the InChIKey of 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol?
The InChIKey is VRXQVJYLEBOPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O2/c1-3-7-17-18-12-15(14-8-5-4-6-9-14)10-11-16(18)13-19(22-2)20(17)21/h3-6,8-13,21H,1,7H2,2H3.
What are the key properties of 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol?
3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol has a molecular weight of 290.36 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-7-phenyl-1-prop-2-enylnaphthalen-2-ol is sourced from PubChem (CID 138978939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).