7-cyclohexyl-2-(3-methylphenyl)quinoline

C22H23N — CID 138464250

IUPAC7-cyclohexyl-2-(3-methylphenyl)quinoline
SMILESCc1cccc(-c2ccc3ccc(C4CCCCC4)cc3n2)c1
InChIInChI=1S/C22H23N/c1-16-6-5-9-20(14-16)21-13-12-18-10-11-19(15-22(18)23-21)17-7-3-2-4-8-17/h5-6,9-15,17H,2-4,7-8H2,1H3
InChIKeyKTYPVIQBVNMFJL-UHFFFAOYSA-N
MW301.43 g/mol
LogP6.26
Rot. Bonds2

About 7-cyclohexyl-2-(3-methylphenyl)quinoline

7-cyclohexyl-2-(3-methylphenyl)quinoline (PubChem CID 138464250) has the molecular formula C22H23N and a molecular weight of 301.43 g/mol. Its IUPAC name is 7-cyclohexyl-2-(3-methylphenyl)quinoline.

Molecular Properties

Compound Name7-cyclohexyl-2-(3-methylphenyl)quinoline
PubChem CID138464250
Molecular FormulaC22H23N
Molecular Weight301.43 g/mol
Exact Mass301.18
IUPAC Name7-cyclohexyl-2-(3-methylphenyl)quinoline
SMILESCc1cccc(-c2ccc3ccc(C4CCCCC4)cc3n2)c1
InChIInChI=1S/C22H23N/c1-16-6-5-9-20(14-16)21-13-12-18-10-11-19(15-22(18)23-21)17-7-3-2-4-8-17/h5-6,9-15,17H,2-4,7-8H2,1H3
InChIKeyKTYPVIQBVNMFJL-UHFFFAOYSA-N
XLogP6.26
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.43
LogP ≤ 56.26
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
6-cyclohexyl-2-(3,5-dimethylphenyl)quinoline
CID 138464247
5-cyclohexyl-2-(3-methylphenyl)quinoline
CID 138464216
iridium;tris(7-methyl-2-(3-methylphenyl)quinoline)
CID 159550728
4-cyclopentyl-2-(3-methylphenyl)quinoline
CID 138464462
5-chloro-2-(3-cyclohexyl-5-methylphenyl)quinoline
CID 154960050
2-(3-methylphenyl)-7-propylquinoline
CID 157170662
7-cyclopentylquinoline
CID 150521921
4-cyclohexyl-6-(3-methylphenyl)-1,3,5-triazin-2-amine
CID 63867917
carbanide;(Z)-4-hydroxypent-3-en-2-one;iridium;7-methyl-2-(3-methylphenyl)quinoline
CID 176631221
2,6-dicyclopentylnaphthalene
CID 91354429
2-(3-methylphenyl)pyridine;bis(2-phenylquinoline);ruthenium(3+)
CID 172795269

Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-2-(3-methylphenyl)quinoline?
The IUPAC name of 7-cyclohexyl-2-(3-methylphenyl)quinoline (CID 138464250) is 7-cyclohexyl-2-(3-methylphenyl)quinoline.
What is the SMILES notation for 7-cyclohexyl-2-(3-methylphenyl)quinoline?
The canonical SMILES for 7-cyclohexyl-2-(3-methylphenyl)quinoline is Cc1cccc(-c2ccc3ccc(C4CCCCC4)cc3n2)c1.
What is the InChIKey of 7-cyclohexyl-2-(3-methylphenyl)quinoline?
The InChIKey is KTYPVIQBVNMFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N/c1-16-6-5-9-20(14-16)21-13-12-18-10-11-19(15-22(18)23-21)17-7-3-2-4-8-17/h5-6,9-15,17H,2-4,7-8H2,1H3.
What are the key properties of 7-cyclohexyl-2-(3-methylphenyl)quinoline?
7-cyclohexyl-2-(3-methylphenyl)quinoline has a molecular weight of 301.43 g/mol, XLogP of 6.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-2-(3-methylphenyl)quinoline is sourced from PubChem (CID 138464250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).