N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine

C15H19N3O — CID 62285578

IUPACN-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine
SMILESCNCc1cc(N2CCOCC2)nc2ccccc12
InChIInChI=1S/C15H19N3O/c1-16-11-12-10-15(18-6-8-19-9-7-18)17-14-5-3-2-4-13(12)14/h2-5,10,16H,6-9,11H2,1H3
InChIKeyCJSJJFXTBYNNPF-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.79
Rot. Bonds3

About N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine

N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine (PubChem CID 62285578) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine
PubChem CID62285578
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine
SMILESCNCc1cc(N2CCOCC2)nc2ccccc12
InChIInChI=1S/C15H19N3O/c1-16-11-12-10-15(18-6-8-19-9-7-18)17-14-5-3-2-4-13(12)14/h2-5,10,16H,6-9,11H2,1H3
InChIKeyCJSJJFXTBYNNPF-UHFFFAOYSA-N
XLogP1.79
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine (CID 62285578) is N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine is CNCc1cc(N2CCOCC2)nc2ccccc12.
What is the InChIKey of N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine?
The InChIKey is CJSJJFXTBYNNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-16-11-12-10-15(18-6-8-19-9-7-18)17-14-5-3-2-4-13(12)14/h2-5,10,16H,6-9,11H2,1H3.
What are the key properties of N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine?
N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine has a molecular weight of 257.34 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-morpholin-4-ylquinolin-4-yl)methanamine is sourced from PubChem (CID 62285578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).