N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine

C19H20N2 — CID 58409410

IUPACN-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine
SMILESCc1cc(C)c2cccc(Nc3c(C)cccc3C)c2n1
InChIInChI=1S/C19H20N2/c1-12-7-5-8-13(2)18(12)21-17-10-6-9-16-14(3)11-15(4)20-19(16)17/h5-11,21H,1-4H3
InChIKeyWLRWLTGWANEATN-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.21
Rot. Bonds2

About N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine

N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine (PubChem CID 58409410) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine
PubChem CID58409410
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC NameN-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine
SMILESCc1cc(C)c2cccc(Nc3c(C)cccc3C)c2n1
InChIInChI=1S/C19H20N2/c1-12-7-5-8-13(2)18(12)21-17-10-6-9-16-14(3)11-15(4)20-19(16)17/h5-11,21H,1-4H3
InChIKeyWLRWLTGWANEATN-UHFFFAOYSA-N
XLogP5.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine?
The IUPAC name of N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine (CID 58409410) is N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine?
The canonical SMILES for N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine is Cc1cc(C)c2cccc(Nc3c(C)cccc3C)c2n1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine?
The InChIKey is WLRWLTGWANEATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-12-7-5-8-13(2)18(12)21-17-10-6-9-16-14(3)11-15(4)20-19(16)17/h5-11,21H,1-4H3.
What are the key properties of N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine?
N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine has a molecular weight of 276.38 g/mol, XLogP of 5.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2,4-dimethylquinolin-8-amine is sourced from PubChem (CID 58409410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).