1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene

C22H25Cl — CID 123892030

IUPAC1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene
SMILESClc1ccc(C2CCC(C3CCCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H25Cl/c23-20-14-12-17(13-15-20)16-8-10-19(11-9-16)22-7-3-5-18-4-1-2-6-21(18)22/h1-2,4,6,12-16,19,22H,3,5,7-11H2
InChIKeyXVBGTYJBYCAULD-UHFFFAOYSA-N
MW324.89 g/mol
LogP6.73
Rot. Bonds2

About 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene

1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene (PubChem CID 123892030) has the molecular formula C22H25Cl and a molecular weight of 324.89 g/mol. Its IUPAC name is 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene
PubChem CID123892030
Molecular FormulaC22H25Cl
Molecular Weight324.89 g/mol
Exact Mass324.16
IUPAC Name1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene
SMILESClc1ccc(C2CCC(C3CCCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H25Cl/c23-20-14-12-17(13-15-20)16-8-10-19(11-9-16)22-7-3-5-18-4-1-2-6-21(18)22/h1-2,4,6,12-16,19,22H,3,5,7-11H2
InChIKeyXVBGTYJBYCAULD-UHFFFAOYSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.89
LogP ≤ 56.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-[4-(4-chlorophenyl)cyclohexyl]-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-chloro-4-(4-cyclobutylcyclohexyl)benzene
CID 70797476
1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene
CID 156649341
(1S)-1-cyclopentyl-2,3-dihydro-1H-indene
CID 134946753
1-cyclopentyl-1,2,3,4-tetrahydronaphthalene;pentane
CID 158506578
(4R)-1-ethyl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)azepane
CID 141010312
N-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43119146
1-(4-chlorophenyl)-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]thiourea
CID 8669333
1-chloro-4-(4-cyclohexylcyclohexyl)benzene;5-(4-cyclohexylcyclohexyl)-1,2,3-trifluorobenzene
CID 144554072
2,3,4,4a,9,9a-hexahydro-1H-fluorene
CID 519137
2-chloro-3-[4-(4-chlorophenyl)cyclohexyl]-4H-naphthalen-1-one
CID 90700809
4-[(1S)-2,3-dihydro-1H-inden-1-yl]piperidine
CID 92981221
2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3,5,7-tetrazatricyclo[3.3.1.13,7]decane
CID 22102285

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene (CID 123892030) is 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene is Clc1ccc(C2CCC(C3CCCc4ccccc43)CC2)cc1.
What is the InChIKey of 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene?
The InChIKey is XVBGTYJBYCAULD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25Cl/c23-20-14-12-17(13-15-20)16-8-10-19(11-9-16)22-7-3-5-18-4-1-2-6-21(18)22/h1-2,4,6,12-16,19,22H,3,5,7-11H2.
What are the key properties of 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene?
1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene has a molecular weight of 324.89 g/mol, XLogP of 6.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-chlorophenyl)cyclohexyl]-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 123892030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).