N-methyl-2-naphthalen-2-ylquinolin-4-amine

C20H16N2 — CID 142840384

IUPACN-methyl-2-naphthalen-2-ylquinolin-4-amine
SMILESCNc1cc(-c2ccc3ccccc3c2)nc2ccccc12
InChIInChI=1S/C20H16N2/c1-21-20-13-19(22-18-9-5-4-8-17(18)20)16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22)
InChIKeySAOFFAODRTVTKK-UHFFFAOYSA-N
MW284.36 g/mol
LogP5.10
Rot. Bonds2

About N-methyl-2-naphthalen-2-ylquinolin-4-amine

N-methyl-2-naphthalen-2-ylquinolin-4-amine (PubChem CID 142840384) has the molecular formula C20H16N2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-methyl-2-naphthalen-2-ylquinolin-4-amine.

Molecular Properties

Compound NameN-methyl-2-naphthalen-2-ylquinolin-4-amine
PubChem CID142840384
Molecular FormulaC20H16N2
Molecular Weight284.36 g/mol
Exact Mass284.13
IUPAC NameN-methyl-2-naphthalen-2-ylquinolin-4-amine
SMILESCNc1cc(-c2ccc3ccccc3c2)nc2ccccc12
InChIInChI=1S/C20H16N2/c1-21-20-13-19(22-18-9-5-4-8-17(18)20)16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22)
InChIKeySAOFFAODRTVTKK-UHFFFAOYSA-N
XLogP5.10
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.36
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-naphthalen-2-ylquinolin-4-amine?
The IUPAC name of N-methyl-2-naphthalen-2-ylquinolin-4-amine (CID 142840384) is N-methyl-2-naphthalen-2-ylquinolin-4-amine.
What is the SMILES notation for N-methyl-2-naphthalen-2-ylquinolin-4-amine?
The canonical SMILES for N-methyl-2-naphthalen-2-ylquinolin-4-amine is CNc1cc(-c2ccc3ccccc3c2)nc2ccccc12.
What is the InChIKey of N-methyl-2-naphthalen-2-ylquinolin-4-amine?
The InChIKey is SAOFFAODRTVTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2/c1-21-20-13-19(22-18-9-5-4-8-17(18)20)16-11-10-14-6-2-3-7-15(14)12-16/h2-13H,1H3,(H,21,22).
What are the key properties of N-methyl-2-naphthalen-2-ylquinolin-4-amine?
N-methyl-2-naphthalen-2-ylquinolin-4-amine has a molecular weight of 284.36 g/mol, XLogP of 5.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-naphthalen-2-ylquinolin-4-amine is sourced from PubChem (CID 142840384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).