7-methoxy-1-methyl-3-phenylnaphthalene

C18H16O — CID 53497213

IUPAC7-methoxy-1-methyl-3-phenylnaphthalene
SMILESCOc1ccc2cc(-c3ccccc3)cc(C)c2c1
InChIInChI=1S/C18H16O/c1-13-10-16(14-6-4-3-5-7-14)11-15-8-9-17(19-2)12-18(13)15/h3-12H,1-2H3
InChIKeyJSJMBHQJKGEZNQ-UHFFFAOYSA-N
MW248.32 g/mol
LogP4.82
Rot. Bonds2

About 7-methoxy-1-methyl-3-phenylnaphthalene

7-methoxy-1-methyl-3-phenylnaphthalene (PubChem CID 53497213) has the molecular formula C18H16O and a molecular weight of 248.32 g/mol. Its IUPAC name is 7-methoxy-1-methyl-3-phenylnaphthalene.

Molecular Properties

Compound Name7-methoxy-1-methyl-3-phenylnaphthalene
PubChem CID53497213
Molecular FormulaC18H16O
Molecular Weight248.32 g/mol
Exact Mass248.12
IUPAC Name7-methoxy-1-methyl-3-phenylnaphthalene
SMILESCOc1ccc2cc(-c3ccccc3)cc(C)c2c1
InChIInChI=1S/C18H16O/c1-13-10-16(14-6-4-3-5-7-14)11-15-8-9-17(19-2)12-18(13)15/h3-12H,1-2H3
InChIKeyJSJMBHQJKGEZNQ-UHFFFAOYSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7-methoxy-1-methyl-3-phenylnaphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3-methoxyphenyl)-1-methylnaphthalene
CID 59399504
2-methoxy-6-phenylnaphthalene
CID 11253308
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
2-methoxynaphthalene;2-phenylnaphthalene
CID 173269029
4-(4-methoxyphenyl)-1-methyl-2,6-diphenylpyridin-1-ium
CID 2326756
1,1'-biphenyl;1,4-dimethoxy-2-methylbenzene
CID 159369138
2-methoxy-3-methyl-5-phenylphenol
CID 132557865
methane;1-methoxy-4-methylbenzene;1-methyl-4-phenylbenzene
CID 160612603
5-(4-methoxyphenyl)-1,2,3-trimethylbenzene
CID 132540116
1-methyl-3-(4-methylnaphthalen-2-yl)naphthalene
CID 58049667
1-methoxy-4-phenylbenzene;methyloxidanium
CID 144616924
1,3-dimethoxy-5-phenylbenzene
CID 11469945

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-methyl-3-phenylnaphthalene?
The IUPAC name of 7-methoxy-1-methyl-3-phenylnaphthalene (CID 53497213) is 7-methoxy-1-methyl-3-phenylnaphthalene.
What is the SMILES notation for 7-methoxy-1-methyl-3-phenylnaphthalene?
The canonical SMILES for 7-methoxy-1-methyl-3-phenylnaphthalene is COc1ccc2cc(-c3ccccc3)cc(C)c2c1.
What is the InChIKey of 7-methoxy-1-methyl-3-phenylnaphthalene?
The InChIKey is JSJMBHQJKGEZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O/c1-13-10-16(14-6-4-3-5-7-14)11-15-8-9-17(19-2)12-18(13)15/h3-12H,1-2H3.
What are the key properties of 7-methoxy-1-methyl-3-phenylnaphthalene?
7-methoxy-1-methyl-3-phenylnaphthalene has a molecular weight of 248.32 g/mol, XLogP of 4.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-methyl-3-phenylnaphthalene is sourced from PubChem (CID 53497213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).