2-methyl-6-(4-methylphenoxy)quinolin-4-amine

C17H16N2O — CID 62197727

IUPAC2-methyl-6-(4-methylphenoxy)quinolin-4-amine
SMILESCc1ccc(Oc2ccc3nc(C)cc(N)c3c2)cc1
InChIInChI=1S/C17H16N2O/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3,(H2,18,19)
InChIKeyLMWNJMJZZFGUHB-UHFFFAOYSA-N
MW264.33 g/mol
LogP4.23
Rot. Bonds2

About 2-methyl-6-(4-methylphenoxy)quinolin-4-amine

2-methyl-6-(4-methylphenoxy)quinolin-4-amine (PubChem CID 62197727) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-methyl-6-(4-methylphenoxy)quinolin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(4-methylphenoxy)quinolin-4-amine
PubChem CID62197727
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name2-methyl-6-(4-methylphenoxy)quinolin-4-amine
SMILESCc1ccc(Oc2ccc3nc(C)cc(N)c3c2)cc1
InChIInChI=1S/C17H16N2O/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3,(H2,18,19)
InChIKeyLMWNJMJZZFGUHB-UHFFFAOYSA-N
XLogP4.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-methylphenoxy)quinolin-4-amine?
The IUPAC name of 2-methyl-6-(4-methylphenoxy)quinolin-4-amine (CID 62197727) is 2-methyl-6-(4-methylphenoxy)quinolin-4-amine.
What is the SMILES notation for 2-methyl-6-(4-methylphenoxy)quinolin-4-amine?
The canonical SMILES for 2-methyl-6-(4-methylphenoxy)quinolin-4-amine is Cc1ccc(Oc2ccc3nc(C)cc(N)c3c2)cc1.
What is the InChIKey of 2-methyl-6-(4-methylphenoxy)quinolin-4-amine?
The InChIKey is LMWNJMJZZFGUHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3,(H2,18,19).
What are the key properties of 2-methyl-6-(4-methylphenoxy)quinolin-4-amine?
2-methyl-6-(4-methylphenoxy)quinolin-4-amine has a molecular weight of 264.33 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-methylphenoxy)quinolin-4-amine is sourced from PubChem (CID 62197727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).