cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine

C15H22FN — CID 65299040

IUPACcyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine
SMILESCc1cc(C(N)C2CCCCC2)cc(C)c1F
InChIInChI=1S/C15H22FN/c1-10-8-13(9-11(2)14(10)16)15(17)12-6-4-3-5-7-12/h8-9,12,15H,3-7,17H2,1-2H3
InChIKeyBXWSGVVGYYVUNY-UHFFFAOYSA-N
MW235.35 g/mol
LogP4.02
Rot. Bonds2

About cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine

cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine (PubChem CID 65299040) has the molecular formula C15H22FN and a molecular weight of 235.35 g/mol. Its IUPAC name is cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine.

Molecular Properties

Compound Namecyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine
PubChem CID65299040
Molecular FormulaC15H22FN
Molecular Weight235.35 g/mol
Exact Mass235.17
IUPAC Namecyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine
SMILESCc1cc(C(N)C2CCCCC2)cc(C)c1F
InChIInChI=1S/C15H22FN/c1-10-8-13(9-11(2)14(10)16)15(17)12-6-4-3-5-7-12/h8-9,12,15H,3-7,17H2,1-2H3
InChIKeyBXWSGVVGYYVUNY-UHFFFAOYSA-N
XLogP4.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine 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

(S)-cyclohexyl-(4-fluoro-3-methylphenyl)methanamine
CID 39244944
5-[chloro(cyclohexyl)methyl]-2-fluoro-1,3-dimethylbenzene
CID 65296894
(R)-cyclohexyl-(3,5-difluorophenyl)methanamine;hydrochloride
CID 171204514
(R)-cyclohexyl-(3,4-dimethylphenyl)methanamine;hydrochloride
CID 171200491
5-[chloro(cyclopentyl)methyl]-2-fluoro-1,3-dimethylbenzene
CID 65297249
cyclohexyl-(2,6-dimethyl-4-pyridinyl)methanamine
CID 107503026
2-cyclopentyl-1-(4-fluoro-3,5-dimethylphenyl)ethanamine
CID 65299332
(4-butylcyclohexyl)-(4-fluoro-3,5-dimethylphenyl)methanamine
CID 65299288
4-[(S)-amino(cyclobutyl)methyl]-2,6-dimethylphenol;hydrochloride
CID 171224638
(R)-cyclobutyl-(3-fluoro-5-methylphenyl)methanamine
CID 130054445
(S)-cyclobutyl-(3,5-dimethylphenyl)methanamine
CID 130055056
cyclohexyl-(2,4-difluoro-5-methylphenyl)methanamine
CID 79724300

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine?
The IUPAC name of cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine (CID 65299040) is cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine.
What is the SMILES notation for cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine?
The canonical SMILES for cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine is Cc1cc(C(N)C2CCCCC2)cc(C)c1F.
What is the InChIKey of cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine?
The InChIKey is BXWSGVVGYYVUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN/c1-10-8-13(9-11(2)14(10)16)15(17)12-6-4-3-5-7-12/h8-9,12,15H,3-7,17H2,1-2H3.
What are the key properties of cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine?
cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine has a molecular weight of 235.35 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(4-fluoro-3,5-dimethylphenyl)methanamine is sourced from PubChem (CID 65299040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).