1-bromo-4-(1-phenylcyclohexyl)benzene

C18H19Br — CID 163634651

IUPAC1-bromo-4-(1-phenylcyclohexyl)benzene
SMILESBrc1ccc(C2(c3ccccc3)CCCCC2)cc1
InChIInChI=1S/C18H19Br/c19-17-11-9-16(10-12-17)18(13-5-2-6-14-18)15-7-3-1-4-8-15/h1,3-4,7-12H,2,5-6,13-14H2
InChIKeyCSZJNBIYGXFJCT-UHFFFAOYSA-N
MW315.25 g/mol
LogP5.70
Rot. Bonds2

About 1-bromo-4-(1-phenylcyclohexyl)benzene

1-bromo-4-(1-phenylcyclohexyl)benzene (PubChem CID 163634651) has the molecular formula C18H19Br and a molecular weight of 315.25 g/mol. Its IUPAC name is 1-bromo-4-(1-phenylcyclohexyl)benzene.

Molecular Properties

Compound Name1-bromo-4-(1-phenylcyclohexyl)benzene
PubChem CID163634651
Molecular FormulaC18H19Br
Molecular Weight315.25 g/mol
Exact Mass314.07
IUPAC Name1-bromo-4-(1-phenylcyclohexyl)benzene
SMILESBrc1ccc(C2(c3ccccc3)CCCCC2)cc1
InChIInChI=1S/C18H19Br/c19-17-11-9-16(10-12-17)18(13-5-2-6-14-18)15-7-3-1-4-8-15/h1,3-4,7-12H,2,5-6,13-14H2
InChIKeyCSZJNBIYGXFJCT-UHFFFAOYSA-N
XLogP5.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.25
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-bromo-4-(1-phenylcyclohexyl)benzene 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-diphenylcyclotetradecane
CID 175822005
ethane;methanol;(1-phenylcyclohexyl)benzene
CID 91580542
1-(4-bromophenyl)-4-phenylbicyclo[2.2.2]octane
CID 134223965
9-N,9-N,10-N,10-N-tetrakis[4-(1-phenylcyclohexyl)phenyl]anthracene-9,10-diamine
CID 20665535
4,4-diphenylcyclotridecan-1-amine
CID 175822045
1-(4-bromophenyl)cyclohexane-1-carbaldehyde
CID 82133968
[4-(1-phenylcyclohexyl)phenyl] dihydrogen phosphate
CID 16734689
4-[1-(4-hydroxyphenyl)cyclotridecyl]phenol
CID 59289752
2'-bromo-1,1-bis(4-bromophenyl)spiro[cyclohexane-4,9'-fluorene]
CID 89459013
(1-phenylcyclopentyl)phosphane
CID 156579190
4-bromo-2-[3-(1-phenylcyclohexyl)-1,2,4-oxadiazol-5-yl]phenol
CID 174552789
1-bromo-4-[1-(chloromethyl)cyclohexyl]benzene
CID 82094186

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-(1-phenylcyclohexyl)benzene?
The IUPAC name of 1-bromo-4-(1-phenylcyclohexyl)benzene (CID 163634651) is 1-bromo-4-(1-phenylcyclohexyl)benzene.
What is the SMILES notation for 1-bromo-4-(1-phenylcyclohexyl)benzene?
The canonical SMILES for 1-bromo-4-(1-phenylcyclohexyl)benzene is Brc1ccc(C2(c3ccccc3)CCCCC2)cc1.
What is the InChIKey of 1-bromo-4-(1-phenylcyclohexyl)benzene?
The InChIKey is CSZJNBIYGXFJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Br/c19-17-11-9-16(10-12-17)18(13-5-2-6-14-18)15-7-3-1-4-8-15/h1,3-4,7-12H,2,5-6,13-14H2.
What are the key properties of 1-bromo-4-(1-phenylcyclohexyl)benzene?
1-bromo-4-(1-phenylcyclohexyl)benzene has a molecular weight of 315.25 g/mol, XLogP of 5.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-(1-phenylcyclohexyl)benzene is sourced from PubChem (CID 163634651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).