1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine

C14H20BrN — CID 84812388

IUPAC1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine
SMILESCCc1ccc(Br)cc1C1(N)CCCCC1
InChIInChI=1S/C14H20BrN/c1-2-11-6-7-12(15)10-13(11)14(16)8-4-3-5-9-14/h6-7,10H,2-5,8-9,16H2,1H3
InChIKeyLJUMFKKRTGHMHU-UHFFFAOYSA-N
MW282.22 g/mol
LogP4.13
Rot. Bonds2

About 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine

1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine (PubChem CID 84812388) has the molecular formula C14H20BrN and a molecular weight of 282.22 g/mol. Its IUPAC name is 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine
PubChem CID84812388
Molecular FormulaC14H20BrN
Molecular Weight282.22 g/mol
Exact Mass281.08
IUPAC Name1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine
SMILESCCc1ccc(Br)cc1C1(N)CCCCC1
InChIInChI=1S/C14H20BrN/c1-2-11-6-7-12(15)10-13(11)14(16)8-4-3-5-9-14/h6-7,10H,2-5,8-9,16H2,1H3
InChIKeyLJUMFKKRTGHMHU-UHFFFAOYSA-N
XLogP4.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.22
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine 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-(5-bromo-2-ethylphenyl)cyclohexane-1-carboxylic acid
CID 117496068
2-(1-aminocyclohexyl)-4-bromophenol
CID 82625595
1-(4-bromo-2-methylphenyl)cyclohexan-1-amine
CID 82305048
2-(1-aminocyclopentyl)-4-bromoaniline
CID 89287686
1-[4-bromo-2-(methoxymethyl)phenyl]cyclopentan-1-amine
CID 117457054
1-(4-bromo-2-methoxyphenyl)cyclohexan-1-amine
CID 117457081
1-(4-bromo-2-fluorophenyl)cyclopentan-1-amine
CID 83412154
1-(5-bromo-2,3-dimethylphenyl)cyclohexan-1-amine
CID 117453302
1-(3,4-diethylphenyl)cyclobutan-1-amine
CID 117292089
1-(5-ethyl-2-methylphenyl)cyclohexan-1-amine
CID 117310158
1-[(4-bromo-2-chlorophenyl)methyl]cycloheptan-1-amine
CID 113471164
1-(5-chloro-2-ethyl-4-methoxyphenyl)cyclopentan-1-amine
CID 117388014

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine?
The IUPAC name of 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine (CID 84812388) is 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine?
The canonical SMILES for 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine is CCc1ccc(Br)cc1C1(N)CCCCC1.
What is the InChIKey of 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine?
The InChIKey is LJUMFKKRTGHMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrN/c1-2-11-6-7-12(15)10-13(11)14(16)8-4-3-5-9-14/h6-7,10H,2-5,8-9,16H2,1H3.
What are the key properties of 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine?
1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine has a molecular weight of 282.22 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-ethylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 84812388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).