1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene

C22H20O — CID 173318762

IUPAC1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene
SMILESc1ccc(OC2CCC(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C22H20O/c1-3-9-17(10-4-1)19-15-16-22(21-14-8-7-13-20(19)21)23-18-11-5-2-6-12-18/h1-14,19,22H,15-16H2
InChIKeySOCYDARTWBIQGM-UHFFFAOYSA-N
MW300.40 g/mol
LogP5.73
Rot. Bonds3

About 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene

1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 173318762) has the molecular formula C22H20O and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene
PubChem CID173318762
Molecular FormulaC22H20O
Molecular Weight300.40 g/mol
Exact Mass300.15
IUPAC Name1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene
SMILESc1ccc(OC2CCC(c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C22H20O/c1-3-9-17(10-4-1)19-15-16-22(21-14-8-7-13-20(19)21)23-18-11-5-2-6-12-18/h1-14,19,22H,15-16H2
InChIKeySOCYDARTWBIQGM-UHFFFAOYSA-N
XLogP5.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.40
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4R)-N-methyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 54133361
(1R,4R)-N-methyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine;(1S,4S)-N-methyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine;dihydrochloride
CID 175666140
(1S,4S)-N,N-dimethyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 3033039
(1R,4S)-N,N-dimethyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 54587686
1,4-diphenoxy-2,3-dihydro-1H-indene
CID 141398687
tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene;hydrochloride
CID 158531622
(1R,4R)-1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene
CID 100971354
2-phenoxycyclobutan-1-one
CID 12791410
4-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 141294884
(3-phenyl-2,3-dihydro-1H-inden-1-yl) methanesulfonate
CID 20675574
2-methoxy-5-phenyl-2,3,4,5-tetrahydro-1λ6-benzothiepine 1,1-dioxide
CID 67721442
(1R)-1-methyl-3-phenyl-2,3-dihydro-1H-indene
CID 163676750

Frequently Asked Questions

What is the IUPAC name of 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene (CID 173318762) is 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene is c1ccc(OC2CCC(c3ccccc3)c3ccccc32)cc1.
What is the InChIKey of 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is SOCYDARTWBIQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20O/c1-3-9-17(10-4-1)19-15-16-22(21-14-8-7-13-20(19)21)23-18-11-5-2-6-12-18/h1-14,19,22H,15-16H2.
What are the key properties of 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene?
1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 300.40 g/mol, XLogP of 5.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenoxy-4-phenyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 173318762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).