1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene

C22H26 — CID 173460746

IUPAC1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene
SMILESc1ccc(C2(C3CCCc4ccccc43)CCCCC2)cc1
InChIInChI=1S/C22H26/c1-3-12-19(13-4-1)22(16-7-2-8-17-22)21-15-9-11-18-10-5-6-14-20(18)21/h1,3-6,10,12-14,21H,2,7-9,11,15-17H2
InChIKeyYRLDVCLNUIPIKB-UHFFFAOYSA-N
MW290.45 g/mol
LogP6.01
Rot. Bonds2

About 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene

1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 173460746) has the molecular formula C22H26 and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID173460746
Molecular FormulaC22H26
Molecular Weight290.45 g/mol
Exact Mass290.20
IUPAC Name1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene
SMILESc1ccc(C2(C3CCCc4ccccc43)CCCCC2)cc1
InChIInChI=1S/C22H26/c1-3-12-19(13-4-1)22(16-7-2-8-17-22)21-15-9-11-18-10-5-6-14-20(18)21/h1,3-6,10,12-14,21H,2,7-9,11,15-17H2
InChIKeyYRLDVCLNUIPIKB-UHFFFAOYSA-N
XLogP6.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.45
LogP ≤ 56.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(1-phenylcyclohexyl)-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

1-(1,2,3,4-tetrahydronaphthalen-1-yl)cyclopropane-1-carbonitrile
CID 18975701
8a-phenyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene
CID 611743
4-(1-phenylcyclopentyl)piperidine
CID 83911457
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cycloheptan-1-amine
CID 55243443
1-phenylbicyclo[4.1.0]heptane
CID 582374
CID 59863888
CID 59863888
1,2,3,4-tetrahydronaphthalen-1-ol
CID 10723
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
CID 63772469
1,1-diphenylcyclotetradecane
CID 175822005
spiro[3-oxa-6-azatricyclo[9.4.0.02,7]pentadeca-1(15),11,13-triene-5,1'-cyclohexane]
CID 62520727
7-(1-phenylcyclohexyl)azepan-2-one
CID 101077852
(4aR,9bS)-4a-phenyl-1,2,3,4,5,9b-hexahydroindeno[1,2-b]pyridine
CID 129392517

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene (CID 173460746) is 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene is c1ccc(C2(C3CCCc4ccccc43)CCCCC2)cc1.
What is the InChIKey of 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is YRLDVCLNUIPIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26/c1-3-12-19(13-4-1)22(16-7-2-8-17-22)21-15-9-11-18-10-5-6-14-20(18)21/h1,3-6,10,12-14,21H,2,7-9,11,15-17H2.
What are the key properties of 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene?
1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 290.45 g/mol, XLogP of 6.01, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclohexyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 173460746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).