4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine

C24H31N — CID 139515276

IUPAC4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
SMILESNC1CCC(c2ccc(-c3ccc(C4CCCCC4)cc3)cc2)CC1
InChIInChI=1S/C24H31N/c25-24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h6-13,18,23-24H,1-5,14-17,25H2
InChIKeyIFAZVTGVTRWOAG-UHFFFAOYSA-N
MW333.52 g/mol
LogP6.39
Rot. Bonds3

About 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine

4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine (PubChem CID 139515276) has the molecular formula C24H31N and a molecular weight of 333.52 g/mol. Its IUPAC name is 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
PubChem CID139515276
Molecular FormulaC24H31N
Molecular Weight333.52 g/mol
Exact Mass333.25
IUPAC Name4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine
SMILESNC1CCC(c2ccc(-c3ccc(C4CCCCC4)cc3)cc2)CC1
InChIInChI=1S/C24H31N/c25-24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h6-13,18,23-24H,1-5,14-17,25H2
InChIKeyIFAZVTGVTRWOAG-UHFFFAOYSA-N
XLogP6.39
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.52
LogP ≤ 56.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-4-(4-cyclohexylphenyl)benzene;hydrogen peroxide
CID 175051125
1-cyclopentyl-4-(4-cyclopentylphenyl)benzene;hydrogen peroxide
CID 175056737
nonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1(32),6(46),7,9(45),10(44),11,13(43),14(42),15,17(41),22,24,26,28,30,33,35,37-octadecaene
CID 135033819
1-cyclohexyl-4-(4-methylphenyl)benzene
CID 54213441
3-(4-cyclobutylphenyl)cyclopentan-1-amine
CID 116506752
4-(4-bromophenyl)cycloheptan-1-amine
CID 115049929
2-(4-cyclohexylphenyl)cyclopropan-1-amine
CID 82127011
3-(4-cyclohexylphenyl)aniline
CID 55198652
5-(4-cyclohexylphenyl)pyridin-2-amine
CID 62491509
1,1'-biphenyl;cyclohexylbenzene
CID 141106050
4-(4-cyclohexylphenyl)-2-methylaniline
CID 63424369
1-methyl-4-[4-[4-(4-methylphenyl)cyclohexyl]phenyl]benzene
CID 59265320

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine?
The IUPAC name of 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine (CID 139515276) is 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine?
The canonical SMILES for 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine is NC1CCC(c2ccc(-c3ccc(C4CCCCC4)cc3)cc2)CC1.
What is the InChIKey of 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine?
The InChIKey is IFAZVTGVTRWOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N/c25-24-16-14-23(15-17-24)22-12-10-21(11-13-22)20-8-6-19(7-9-20)18-4-2-1-3-5-18/h6-13,18,23-24H,1-5,14-17,25H2.
What are the key properties of 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine?
4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine has a molecular weight of 333.52 g/mol, XLogP of 6.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-cyclohexylphenyl)phenyl]cyclohexan-1-amine is sourced from PubChem (CID 139515276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).