1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine

C16H22N2O — CID 105378674

IUPAC1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine
SMILESCOCC(C)(C)NCc1ccc2nc(C)ccc2c1
InChIInChI=1S/C16H22N2O/c1-12-5-7-14-9-13(6-8-15(14)18-12)10-17-16(2,3)11-19-4/h5-9,17H,10-11H2,1-4H3
InChIKeyGUOSHEFQDNROOI-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.06
Rot. Bonds5

About 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine

1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine (PubChem CID 105378674) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine
PubChem CID105378674
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine
SMILESCOCC(C)(C)NCc1ccc2nc(C)ccc2c1
InChIInChI=1S/C16H22N2O/c1-12-5-7-14-9-13(6-8-15(14)18-12)10-17-16(2,3)11-19-4/h5-9,17H,10-11H2,1-4H3
InChIKeyGUOSHEFQDNROOI-UHFFFAOYSA-N
XLogP3.06
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-3-[(2-methylquinolin-6-yl)methylamino]butan-1-ol
CID 105378717
3-ethyl-N-[(2-methylquinolin-6-yl)methyl]pentan-3-amine
CID 105378521
N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 81231391
2-methyl-N-[2-(2-methylquinolin-6-yl)ethyl]propan-2-amine
CID 81224077
N-(1H-indol-6-ylmethyl)-1-methoxy-2-methylpropan-2-amine
CID 102911940
1-methoxy-N-[(2-methylquinolin-6-yl)methyl]butan-2-amine
CID 105378496
1-(4-bromophenyl)-N-[(2-methylquinolin-6-yl)methyl]methanamine
CID 105378223
2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-1-amine
CID 81231609
3-methyl-N-[(2-methylquinolin-6-yl)methyl]pentan-2-amine
CID 105378393
3,3,3-trifluoro-N-[(2-methylquinolin-6-yl)methyl]propan-1-amine
CID 105378460
(2-methylquinolin-6-yl)methanethiol
CID 105379811
N-tert-butyl-2-methyl-3-(2-methylquinolin-6-yl)propan-1-amine
CID 81222174

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine?
The IUPAC name of 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine (CID 105378674) is 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine?
The canonical SMILES for 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine is COCC(C)(C)NCc1ccc2nc(C)ccc2c1.
What is the InChIKey of 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine?
The InChIKey is GUOSHEFQDNROOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12-5-7-14-9-13(6-8-15(14)18-12)10-17-16(2,3)11-19-4/h5-9,17H,10-11H2,1-4H3.
What are the key properties of 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine?
1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine has a molecular weight of 258.37 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methyl-N-[(2-methylquinolin-6-yl)methyl]propan-2-amine is sourced from PubChem (CID 105378674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).