8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline

C24H28N2O — CID 27487089

IUPAC8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline
SMILESCc1ccc(C)c(COc2cccc3ccc(N4CCC[C@@H](C)C4)nc23)c1
InChIInChI=1S/C24H28N2O/c1-17-9-10-19(3)21(14-17)16-27-22-8-4-7-20-11-12-23(25-24(20)22)26-13-5-6-18(2)15-26/h4,7-12,14,18H,5-6,13,15-16H2,1-3H3/t18-/m1/s1
InChIKeyMFVRMEDWOWMLFU-GOSISDBHSA-N
MW360.50 g/mol
LogP5.67
Rot. Bonds4

About 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline

8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline (PubChem CID 27487089) has the molecular formula C24H28N2O and a molecular weight of 360.50 g/mol. Its IUPAC name is 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline.

Molecular Properties

Compound Name8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline
PubChem CID27487089
Molecular FormulaC24H28N2O
Molecular Weight360.50 g/mol
Exact Mass360.22
IUPAC Name8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline
SMILESCc1ccc(C)c(COc2cccc3ccc(N4CCC[C@@H](C)C4)nc23)c1
InChIInChI=1S/C24H28N2O/c1-17-9-10-19(3)21(14-17)16-27-22-8-4-7-20-11-12-23(25-24(20)22)26-13-5-6-18(2)15-26/h4,7-12,14,18H,5-6,13,15-16H2,1-3H3/t18-/m1/s1
InChIKeyMFVRMEDWOWMLFU-GOSISDBHSA-N
XLogP5.67
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.50
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline with MolForge

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Related Compounds

2-(4-benzylpiperidin-1-yl)-8-[(2,5-dimethylphenyl)methoxy]quinoline
CID 16812587
N-(3,5-dimethylphenyl)-2-[2-[(3R)-3-methylpiperidin-1-yl]quinolin-8-yl]oxyacetamide
CID 27476098
methyl 4-[[2-(3-methylpiperidin-1-yl)quinolin-8-yl]oxymethyl]benzoate
CID 16801826
1-[8-[(3-methylphenyl)methoxy]quinolin-2-yl]piperidine-4-carboxamide
CID 18570691
4-(3-methylpiperidin-1-yl)-6-(2-methylquinolin-8-yl)oxypyrimidin-5-amine
CID 19139925
2-[5-[(2,5-dimethylphenoxy)methyl]furan-2-yl]-5-[(3R)-3-methylpiperidin-1-yl]-1,3-oxazole-4-carbonitrile
CID 51660697
1,4-dimethyl-2-[(2-methylphenoxy)methyl]benzene
CID 60627928
2-piperidin-1-yl-8-[[3-(trifluoromethyl)phenyl]methoxy]quinoline
CID 16812558
1-[8-[2-(2,4-dimethylanilino)-2-oxoethoxy]quinolin-2-yl]piperidine-4-carboxamide
CID 16801829
5-methyl-4-(3-methylpiperidin-1-yl)-2-(2-naphthalen-1-ylethyl)pyridine;hydrochloride
CID 14441370
6-(3-methylpiperidin-1-yl)-N-propylpyridin-2-amine
CID 80764364
6-(3-methylpiperidin-1-yl)-2-(2-methylpropoxy)pyridin-3-amine
CID 43260582

Frequently Asked Questions

What is the IUPAC name of 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline?
The IUPAC name of 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline (CID 27487089) is 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline.
What is the SMILES notation for 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline?
The canonical SMILES for 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline is Cc1ccc(C)c(COc2cccc3ccc(N4CCC[C@@H](C)C4)nc23)c1.
What is the InChIKey of 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline?
The InChIKey is MFVRMEDWOWMLFU-GOSISDBHSA-N. The full InChI is InChI=1S/C24H28N2O/c1-17-9-10-19(3)21(14-17)16-27-22-8-4-7-20-11-12-23(25-24(20)22)26-13-5-6-18(2)15-26/h4,7-12,14,18H,5-6,13,15-16H2,1-3H3/t18-/m1/s1.
What are the key properties of 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline?
8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline has a molecular weight of 360.50 g/mol, XLogP of 5.67, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2,5-dimethylphenyl)methoxy]-2-[(3R)-3-methylpiperidin-1-yl]quinoline is sourced from PubChem (CID 27487089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).