6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene

C28H32O — CID 139853601

IUPAC6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCCCOc1ccc(-c2ccc3c(c2)CCC(c2ccc(CCC)cc2)C3)cc1
InChIInChI=1S/C28H32O/c1-3-5-21-6-8-22(9-7-21)24-10-12-27-20-25(11-13-26(27)19-24)23-14-16-28(17-15-23)29-18-4-2/h6-9,11,13-17,20,24H,3-5,10,12,18-19H2,1-2H3
InChIKeyPQGDZGOUKLYECV-UHFFFAOYSA-N
MW384.56 g/mol
LogP7.37
Rot. Bonds7

About 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene

6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 139853601) has the molecular formula C28H32O and a molecular weight of 384.56 g/mol. Its IUPAC name is 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID139853601
Molecular FormulaC28H32O
Molecular Weight384.56 g/mol
Exact Mass384.25
IUPAC Name6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCCCOc1ccc(-c2ccc3c(c2)CCC(c2ccc(CCC)cc2)C3)cc1
InChIInChI=1S/C28H32O/c1-3-5-21-6-8-22(9-7-21)24-10-12-27-20-25(11-13-26(27)19-24)23-14-16-28(17-15-23)29-18-4-2/h6-9,11,13-17,20,24H,3-5,10,12,18-19H2,1-2H3
InChIKeyPQGDZGOUKLYECV-UHFFFAOYSA-N
XLogP7.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.56
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene 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

6-(4-ethylphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139852181
6-(4-fluorophenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139853199
6-[4-(4-ethenylcyclohexyl)phenyl]-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139853341
2-[4-[(E)-pent-3-enyl]phenyl]-6-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139853671
6-but-3-enoxy-2-(4-butylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139847809
2-(4-butylphenyl)-6-pent-3-enoxy-1,2,3,4-tetrahydronaphthalene
CID 139848040
2-pentyl-6-(4-propoxyphenyl)-1,2,3,4-tetrahydronaphthalene
CID 20500384
2-(4-ethylcyclohexyl)-6-(4-propoxyphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139852543
2-(4-ethylphenyl)-6-pent-4-enoxy-1,2,3,4-tetrahydronaphthalene
CID 139849417
2-(2-fluoro-4-propylphenyl)-6-[4-(trifluoromethoxy)phenyl]-1,2,3,4-tetrahydronaphthalene
CID 139852973
2-ethyl-6-(4-heptoxyphenyl)-1,2,3,4-tetrahydronaphthalene
CID 20500196
2-hexyl-6-(4-pentoxyphenyl)-1,2,3,4-tetrahydronaphthalene
CID 20500404

Frequently Asked Questions

What is the IUPAC name of 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene (CID 139853601) is 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene is CCCOc1ccc(-c2ccc3c(c2)CCC(c2ccc(CCC)cc2)C3)cc1.
What is the InChIKey of 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is PQGDZGOUKLYECV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32O/c1-3-5-21-6-8-22(9-7-21)24-10-12-27-20-25(11-13-26(27)19-24)23-14-16-28(17-15-23)29-18-4-2/h6-9,11,13-17,20,24H,3-5,10,12,18-19H2,1-2H3.
What are the key properties of 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene?
6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 384.56 g/mol, XLogP of 7.37, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 139853601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).