6,8-dichloro-N-methyl-2-phenylquinolin-4-amine

C16H12Cl2N2 — CID 63481402

IUPAC6,8-dichloro-N-methyl-2-phenylquinolin-4-amine
SMILESCNc1cc(-c2ccccc2)nc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C16H12Cl2N2/c1-19-15-9-14(10-5-3-2-4-6-10)20-16-12(15)7-11(17)8-13(16)18/h2-9H,1H3,(H,19,20)
InChIKeyUQYALNPSMVDFLP-UHFFFAOYSA-N
MW303.19 g/mol
LogP5.25
Rot. Bonds2

About 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine

6,8-dichloro-N-methyl-2-phenylquinolin-4-amine (PubChem CID 63481402) has the molecular formula C16H12Cl2N2 and a molecular weight of 303.19 g/mol. Its IUPAC name is 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine.

Molecular Properties

Compound Name6,8-dichloro-N-methyl-2-phenylquinolin-4-amine
PubChem CID63481402
Molecular FormulaC16H12Cl2N2
Molecular Weight303.19 g/mol
Exact Mass302.04
IUPAC Name6,8-dichloro-N-methyl-2-phenylquinolin-4-amine
SMILESCNc1cc(-c2ccccc2)nc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C16H12Cl2N2/c1-19-15-9-14(10-5-3-2-4-6-10)20-16-12(15)7-11(17)8-13(16)18/h2-9H,1H3,(H,19,20)
InChIKeyUQYALNPSMVDFLP-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 ≤ 500303.19
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-N,5-dimethyl-2-phenylquinolin-4-amine
CID 107628740
4,6-dichloro-8-iodo-2-phenylquinoline
CID 107628258
(8-chloro-2-phenylquinolin-4-yl)hydrazine
CID 63483527
6-bromo-4,8-dichloro-2-phenylquinoline
CID 43668562
N-methyl-2-phenyl-6-propan-2-ylquinolin-4-amine
CID 63481504
7-chloro-N-ethyl-8-methyl-2-phenylquinolin-4-amine
CID 63479901
6,8-dichloro-N-methyl-2-(3-methylphenyl)quinazolin-4-amine
CID 64983276
N-tert-butyl-6-chloro-2-phenylquinolin-4-amine
CID 166442508
7-fluoro-N,6-dimethyl-2-phenylquinolin-4-amine
CID 103996202
N-methyl-2-phenyl-6-propylquinolin-4-amine
CID 63481049
6-bromo-8-chloro-2-phenylquinolin-4-amine
CID 55196336
6,8-dichloro-2-(4-chlorophenyl)-N-methylquinazolin-4-amine
CID 64983231

Frequently Asked Questions

What is the IUPAC name of 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine?
The IUPAC name of 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine (CID 63481402) is 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine.
What is the SMILES notation for 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine?
The canonical SMILES for 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine is CNc1cc(-c2ccccc2)nc2c(Cl)cc(Cl)cc12.
What is the InChIKey of 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine?
The InChIKey is UQYALNPSMVDFLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Cl2N2/c1-19-15-9-14(10-5-3-2-4-6-10)20-16-12(15)7-11(17)8-13(16)18/h2-9H,1H3,(H,19,20).
What are the key properties of 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine?
6,8-dichloro-N-methyl-2-phenylquinolin-4-amine has a molecular weight of 303.19 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 6,8-dichloro-N-methyl-2-phenylquinolin-4-amine is sourced from PubChem (CID 63481402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).