6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene

C23H21F — CID 139852847

IUPAC6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc(C2CCc3cc(-c4ccc(F)cc4)ccc3C2)cc1
InChIInChI=1S/C23H21F/c1-16-2-4-17(5-3-16)19-6-8-22-15-20(7-9-21(22)14-19)18-10-12-23(24)13-11-18/h2-5,7,9-13,15,19H,6,8,14H2,1H3
InChIKeyADLWDQCWXJNXNP-UHFFFAOYSA-N
MW316.42 g/mol
LogP6.07
Rot. Bonds2

About 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene

6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 139852847) has the molecular formula C23H21F and a molecular weight of 316.42 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID139852847
Molecular FormulaC23H21F
Molecular Weight316.42 g/mol
Exact Mass316.16
IUPAC Name6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
SMILESCc1ccc(C2CCc3cc(-c4ccc(F)cc4)ccc3C2)cc1
InChIInChI=1S/C23H21F/c1-16-2-4-17(5-3-16)19-6-8-22-15-20(7-9-21(22)14-19)18-10-12-23(24)13-11-18/h2-5,7,9-13,15,19H,6,8,14H2,1H3
InChIKeyADLWDQCWXJNXNP-UHFFFAOYSA-N
XLogP6.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.42
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6-(4-fluorophenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139853199
2-(6-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)-6-methylnaphthalene
CID 139848916
(2R)-2,6-diphenyl-1,2,3,4-tetrahydronaphthalene
CID 95564671
6-(4-ethylphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139852181
5,6-difluoro-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139848451
6-(4-propoxyphenyl)-2-(4-propylphenyl)-1,2,3,4-tetrahydronaphthalene
CID 139853601
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
1-(3,4-dimethylcyclohex-3-en-1-yl)-4-methylbenzene
CID 151968969
5-(4-fluorophenyl)-2,3-dihydro-1H-indene
CID 141092237
6-(3,5-difluorophenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 142035350
2-[4-(4-cyclopropylphenyl)phenyl]-6-[4-(4-fluorophenyl)phenyl]naphthalene
CID 170293668

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene (CID 139852847) is 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene is Cc1ccc(C2CCc3cc(-c4ccc(F)cc4)ccc3C2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is ADLWDQCWXJNXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21F/c1-16-2-4-17(5-3-16)19-6-8-22-15-20(7-9-21(22)14-19)18-10-12-23(24)13-11-18/h2-5,7,9-13,15,19H,6,8,14H2,1H3.
What are the key properties of 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene?
6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 316.42 g/mol, XLogP of 6.07, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-2-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 139852847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).