6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline

C23H25N — CID 138464247

IUPAC6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline
SMILESCc1cc(C)cc(-c2ccc3cc(C4CCCCC4)ccc3n2)c1
InChIInChI=1S/C23H25N/c1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18/h8-15,18H,3-7H2,1-2H3
InChIKeyDFHGAZXQLWHJOE-UHFFFAOYSA-N
MW315.46 g/mol
LogP6.57
Rot. Bonds2

About 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline

6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline (PubChem CID 138464247) has the molecular formula C23H25N and a molecular weight of 315.46 g/mol. Its IUPAC name is 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline.

Molecular Properties

Compound Name6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline
PubChem CID138464247
Molecular FormulaC23H25N
Molecular Weight315.46 g/mol
Exact Mass315.20
IUPAC Name6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline
SMILESCc1cc(C)cc(-c2ccc3cc(C4CCCCC4)ccc3n2)c1
InChIInChI=1S/C23H25N/c1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18/h8-15,18H,3-7H2,1-2H3
InChIKeyDFHGAZXQLWHJOE-UHFFFAOYSA-N
XLogP6.57
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.46
LogP ≤ 56.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-cyclopentyl-2-(3,5-dimethylphenyl)quinoline;6-cyclopentyl-2-(3-methylphenyl)quinoline;7-cyclopentyl-2-(3-methylphenyl)quinoline;7-cyclopentyl-2-phenylquinoline
CID 159254745
7-cyclohexyl-2-(3-methylphenyl)quinoline
CID 138464250
5-chloro-2-(3-cyclohexyl-5-methylphenyl)quinoline
CID 154960050
8-cyclohexyl-1-(3,5-dimethylphenyl)-4-methylbenzo[h]isoquinoline
CID 156512323
2-(3,5-dimethylphenyl)-6-methoxyquinoline
CID 58871188
2,6-dicyclopentylnaphthalene
CID 91354429
5-(cyclopentylmethyl)-2-(3,5-dimethylphenyl)quinoline
CID 138464224
2-(3,5-dimethylphenyl)-6-(3,3,3-trifluoro-2,2-dimethylpropyl)quinoline
CID 138464235
2-(3-tert-butyl-5-methylbenzene-6-id-1-yl)-6-cyclohexylquinoline;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;iridium
CID 153463512
6-cyclohexylphthalazine
CID 21134758
5-cyclohexyl-2-(3-methylphenyl)quinoline
CID 138464216
1-cyclohexyl-4-(4-methylphenyl)benzene
CID 54213441

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline?
The IUPAC name of 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline (CID 138464247) is 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline.
What is the SMILES notation for 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline?
The canonical SMILES for 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline is Cc1cc(C)cc(-c2ccc3cc(C4CCCCC4)ccc3n2)c1.
What is the InChIKey of 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline?
The InChIKey is DFHGAZXQLWHJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N/c1-16-12-17(2)14-21(13-16)23-11-9-20-15-19(8-10-22(20)24-23)18-6-4-3-5-7-18/h8-15,18H,3-7H2,1-2H3.
What are the key properties of 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline?
6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline has a molecular weight of 315.46 g/mol, XLogP of 6.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline is sourced from PubChem (CID 138464247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).