6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene

C18H20O — CID 20500036

IUPAC6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCOc1ccc(-c2ccc3c(c2)CCC(C)C3)cc1
InChIInChI=1S/C18H20O/c1-13-3-4-17-12-16(6-5-15(17)11-13)14-7-9-18(19-2)10-8-14/h5-10,12-13H,3-4,11H2,1-2H3
InChIKeyOPLVDYLSVPKDJS-UHFFFAOYSA-N
MW252.36 g/mol
LogP4.49
Rot. Bonds2

About 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene

6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 20500036) has the molecular formula C18H20O and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene
PubChem CID20500036
Molecular FormulaC18H20O
Molecular Weight252.36 g/mol
Exact Mass252.15
IUPAC Name6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene
SMILESCOc1ccc(-c2ccc3c(c2)CCC(C)C3)cc1
InChIInChI=1S/C18H20O/c1-13-3-4-17-12-16(6-5-15(17)11-13)14-7-9-18(19-2)10-8-14/h5-10,12-13H,3-4,11H2,1-2H3
InChIKeyOPLVDYLSVPKDJS-UHFFFAOYSA-N
XLogP4.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene (CID 20500036) is 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene is COc1ccc(-c2ccc3c(c2)CCC(C)C3)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is OPLVDYLSVPKDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O/c1-13-3-4-17-12-16(6-5-15(17)11-13)14-7-9-18(19-2)10-8-14/h5-10,12-13H,3-4,11H2,1-2H3.
What are the key properties of 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene?
6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 252.36 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 20500036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).