2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene

C19H20O3 — CID 57256243

IUPAC2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene
SMILESCOc1ccc2c(c1)CC=C(c1ccc(OC)c(OC)c1)C2
InChIInChI=1S/C19H20O3/c1-20-17-8-6-14-10-13(4-5-15(14)11-17)16-7-9-18(21-2)19(12-16)22-3/h4,6-9,11-12H,5,10H2,1-3H3
InChIKeyCGVBQYYFQUKGRD-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.89
Rot. Bonds4

About 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene

2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene (PubChem CID 57256243) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene
PubChem CID57256243
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Name2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene
SMILESCOc1ccc2c(c1)CC=C(c1ccc(OC)c(OC)c1)C2
InChIInChI=1S/C19H20O3/c1-20-17-8-6-14-10-13(4-5-15(14)11-17)16-7-9-18(21-2)19(12-16)22-3/h4,6-9,11-12H,5,10H2,1-3H3
InChIKeyCGVBQYYFQUKGRD-UHFFFAOYSA-N
XLogP3.89
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2-(2-methoxyphenyl)-1,4-dihydronaphthalene
CID 57252898
5,6,12,13,19-pentamethoxytetracyclo[15.4.0.03,8.010,15]henicosa-1(17),3,5,7,10,12,14,18,20-nonaene
CID 102106088
4-(cyclopenten-1-yl)-1,2-dimethoxybenzene
CID 71373642
5,6-dimethoxy-3-(4-methoxyphenyl)-1H-indene
CID 19431302
2-[4-(2,5-dimethoxyphenyl)phenyl]-1,4-dimethoxybenzene
CID 172792841
1,2-dimethoxy-4-(5-methoxy-2-methylphenoxy)benzene
CID 123959246
1,2,3,5-tetramethoxybenzene;1,2,4-trimethoxybenzene
CID 54271001
3-amino-2-(3,4-dimethoxyphenyl)-5-methoxyinden-1-one
CID 15882763
3,6-dimethoxy-10H-anthracen-9-one
CID 142018270
6,16-dimethoxy-11-methyl-11-azatricyclo[12.4.0.03,8]octadeca-1(14),3(8),4,6,15,17-hexaene
CID 11573806
2-(3,4-dimethoxyphenoxy)-4-methoxyaniline
CID 123638335
5-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,10,13-hexaen-2-one
CID 54197355

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene (CID 57256243) is 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene is COc1ccc2c(c1)CC=C(c1ccc(OC)c(OC)c1)C2.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene?
The InChIKey is CGVBQYYFQUKGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c1-20-17-8-6-14-10-13(4-5-15(14)11-17)16-7-9-18(21-2)19(12-16)22-3/h4,6-9,11-12H,5,10H2,1-3H3.
What are the key properties of 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene?
2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene has a molecular weight of 296.37 g/mol, XLogP of 3.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-6-methoxy-1,4-dihydronaphthalene is sourced from PubChem (CID 57256243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).