6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine

C17H15ClN2 — CID 730830

IUPAC6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine
SMILESCc1ccc(Nc2cc(C)nc3ccc(Cl)cc23)cc1
InChIInChI=1S/C17H15ClN2/c1-11-3-6-14(7-4-11)20-17-9-12(2)19-16-8-5-13(18)10-15(16)17/h3-10H,1-2H3,(H,19,20)
InChIKeyZECDFNRGUDLZBS-UHFFFAOYSA-N
MW282.77 g/mol
LogP5.25
Rot. Bonds2

About 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine

6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine (PubChem CID 730830) has the molecular formula C17H15ClN2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine.

Molecular Properties

Compound Name6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine
PubChem CID730830
Molecular FormulaC17H15ClN2
Molecular Weight282.77 g/mol
Exact Mass282.09
IUPAC Name6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine
SMILESCc1ccc(Nc2cc(C)nc3ccc(Cl)cc23)cc1
InChIInChI=1S/C17H15ClN2/c1-11-3-6-14(7-4-11)20-17-9-12(2)19-16-8-5-13(18)10-15(16)17/h3-10H,1-2H3,(H,19,20)
InChIKeyZECDFNRGUDLZBS-UHFFFAOYSA-N
XLogP5.25
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.77
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-N-(3,4-dichlorophenyl)-2-methylquinolin-4-amine
CID 730833
2-methyl-4-N-(4-methylphenyl)quinoline-4,6-diamine
CID 22417903
methyl 4-[(6-chloro-2-methylquinolin-4-yl)amino]benzoate
CID 696493
6-chloro-N-(3,4-dimethoxyphenyl)-2-methylquinolin-4-amine
CID 23793112
N-(4-iodophenyl)-2,6-dimethylquinolin-4-amine
CID 1184486
6-chloro-N-(5-chloro-2-methoxyphenyl)-2-methylquinolin-4-amine;hydrochloride
CID 2790562
6-chloro-N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-methylquinolin-4-amine;hydrochloride
CID 2790572
ethyl 4-(4-chloroanilino)-2-methylquinoline-6-carboxylate;hydrochloride
CID 2919127
N-(3-chloro-4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 110435673
2-[(6-chloro-2-methylquinolin-4-yl)amino]ethanol
CID 155175469
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 692374
N-(5-chloro-2-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
CID 886675

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine?
The IUPAC name of 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine (CID 730830) is 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine.
What is the SMILES notation for 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine?
The canonical SMILES for 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine is Cc1ccc(Nc2cc(C)nc3ccc(Cl)cc23)cc1.
What is the InChIKey of 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine?
The InChIKey is ZECDFNRGUDLZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2/c1-11-3-6-14(7-4-11)20-17-9-12(2)19-16-8-5-13(18)10-15(16)17/h3-10H,1-2H3,(H,19,20).
What are the key properties of 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine?
6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine has a molecular weight of 282.77 g/mol, XLogP of 5.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-N-(4-methylphenyl)quinolin-4-amine is sourced from PubChem (CID 730830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).