N-(4-cyclohexylphenyl)-3-fluoroaniline

C18H20FN — CID 166048926

IUPACN-(4-cyclohexylphenyl)-3-fluoroaniline
SMILESFc1cccc(Nc2ccc(C3CCCCC3)cc2)c1
InChIInChI=1S/C18H20FN/c19-16-7-4-8-18(13-16)20-17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14,20H,1-3,5-6H2
InChIKeyOOOKZNAUYRGAEW-UHFFFAOYSA-N
MW269.36 g/mol
LogP5.62
Rot. Bonds3

About N-(4-cyclohexylphenyl)-3-fluoroaniline

N-(4-cyclohexylphenyl)-3-fluoroaniline (PubChem CID 166048926) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is N-(4-cyclohexylphenyl)-3-fluoroaniline.

Molecular Properties

Compound NameN-(4-cyclohexylphenyl)-3-fluoroaniline
PubChem CID166048926
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC NameN-(4-cyclohexylphenyl)-3-fluoroaniline
SMILESFc1cccc(Nc2ccc(C3CCCCC3)cc2)c1
InChIInChI=1S/C18H20FN/c19-16-7-4-8-18(13-16)20-17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14,20H,1-3,5-6H2
InChIKeyOOOKZNAUYRGAEW-UHFFFAOYSA-N
XLogP5.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.36
LogP ≤ 55.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(4-cyclohexylphenyl)-3-fluoroaniline 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

3-fluoro-N-(4-fluorophenyl)aniline
CID 54316192
methyl 3-(4-cyclohexylanilino)benzoate
CID 139962922
N-[4-(4-cyclohexylphenyl)phenyl]-4-phenylaniline
CID 171439106
3-fluoro-N-phenylaniline
CID 2774466
N-(4-cyclohexylphenyl)dibenzothiophen-2-amine
CID 174329595
N-(4-cyclohexylphenyl)-3-(4-phenylnaphthalen-2-yl)aniline
CID 170418074
3-[[4-(4-cyclohexylanilino)benzoyl]amino]benzoic acid
CID 155133623
N-[4-(aminomethyl)phenyl]-3-fluoroaniline
CID 117027398
4-cyclohexyl-N-[4-[1-[4-(4-cyclohexylanilino)phenyl]cyclohexyl]phenyl]aniline
CID 153363759
4-N-cyclohexyl-6-N-(3-fluorophenyl)pyrimidine-4,6-diamine
CID 112856315
N-(4-cyclohexylphenyl)-2,4,6-trimethylaniline
CID 142357623
N-(3-fluorophenyl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 82536030

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclohexylphenyl)-3-fluoroaniline?
The IUPAC name of N-(4-cyclohexylphenyl)-3-fluoroaniline (CID 166048926) is N-(4-cyclohexylphenyl)-3-fluoroaniline.
What is the SMILES notation for N-(4-cyclohexylphenyl)-3-fluoroaniline?
The canonical SMILES for N-(4-cyclohexylphenyl)-3-fluoroaniline is Fc1cccc(Nc2ccc(C3CCCCC3)cc2)c1.
What is the InChIKey of N-(4-cyclohexylphenyl)-3-fluoroaniline?
The InChIKey is OOOKZNAUYRGAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c19-16-7-4-8-18(13-16)20-17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14,20H,1-3,5-6H2.
What are the key properties of N-(4-cyclohexylphenyl)-3-fluoroaniline?
N-(4-cyclohexylphenyl)-3-fluoroaniline has a molecular weight of 269.36 g/mol, XLogP of 5.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclohexylphenyl)-3-fluoroaniline is sourced from PubChem (CID 166048926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).