N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine

C19H19ClN2O — CID 110432981

IUPACN-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(NCCc3ccc(Cl)cc3)c2c1
InChIInChI=1S/C19H19ClN2O/c1-13-11-19(17-12-16(23-2)7-8-18(17)22-13)21-10-9-14-3-5-15(20)6-4-14/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKeyIUCCUJJXCGPYSL-UHFFFAOYSA-N
MW326.83 g/mol
LogP4.86
Rot. Bonds5

About N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine

N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine (PubChem CID 110432981) has the molecular formula C19H19ClN2O and a molecular weight of 326.83 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine
PubChem CID110432981
Molecular FormulaC19H19ClN2O
Molecular Weight326.83 g/mol
Exact Mass326.12
IUPAC NameN-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(NCCc3ccc(Cl)cc3)c2c1
InChIInChI=1S/C19H19ClN2O/c1-13-11-19(17-12-16(23-2)7-8-18(17)22-13)21-10-9-14-3-5-15(20)6-4-14/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKeyIUCCUJJXCGPYSL-UHFFFAOYSA-N
XLogP4.86
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.83
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-6-methoxyquinolin-4-amine
CID 70112929
N-(2,6-dimethylquinolin-4-yl)-N'-(6-methoxy-2-methylquinolin-4-yl)pentane-1,5-diamine
CID 11407724
N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-6-methoxy-2-methylquinolin-4-amine
CID 166627540
8-methoxy-N-[2-(4-methoxyphenyl)ethyl]-2-methylquinolin-4-amine
CID 110432820
N-(5-chloro-2-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
CID 886675
2-chloro-N-[2-(4-methoxyphenyl)ethyl]-6-methylpyrimidin-4-amine
CID 62476087
2-[(6-chloro-2-methylquinolin-4-yl)amino]ethanol
CID 155175469
4-N-[(4-chlorophenyl)methyl]-2-N-[2-(4-methoxyphenyl)ethyl]-6-methylpyrimidine-2,4-diamine
CID 112917972
N-(3-chloro-4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 110435673
4-methoxy-N-[2-[(6-methoxy-2-methylquinolin-4-yl)amino]ethyl]-N-[3-[(6-methoxy-2-methylquinolin-4-yl)amino]propyl]benzenesulfonamide
CID 58807114
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 692374
4-[2-[(2-methylquinolin-4-yl)amino]ethyl]phenol
CID 61238902

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine (CID 110432981) is N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine is COc1ccc2nc(C)cc(NCCc3ccc(Cl)cc3)c2c1.
What is the InChIKey of N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine?
The InChIKey is IUCCUJJXCGPYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O/c1-13-11-19(17-12-16(23-2)7-8-18(17)22-13)21-10-9-14-3-5-15(20)6-4-14/h3-8,11-12H,9-10H2,1-2H3,(H,21,22).
What are the key properties of N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine?
N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine has a molecular weight of 326.83 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)ethyl]-6-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 110432981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).