2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine

C16H22N2O2 — CID 104759612

IUPAC2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine
SMILESCOc1cccc2ccc(CNCC(C)(C)OC)nc12
InChIInChI=1S/C16H22N2O2/c1-16(2,20-4)11-17-10-13-9-8-12-6-5-7-14(19-3)15(12)18-13/h5-9,17H,10-11H2,1-4H3
InChIKeyGPNNYQZKBXEFQM-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.76
Rot. Bonds6

About 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine

2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine (PubChem CID 104759612) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine
PubChem CID104759612
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine
SMILESCOc1cccc2ccc(CNCC(C)(C)OC)nc12
InChIInChI=1S/C16H22N2O2/c1-16(2,20-4)11-17-10-13-9-8-12-6-5-7-14(19-3)15(12)18-13/h5-9,17H,10-11H2,1-4H3
InChIKeyGPNNYQZKBXEFQM-UHFFFAOYSA-N
XLogP2.76
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-difluoro-3-[(8-methoxyquinolin-2-yl)methylamino]propan-1-ol
CID 106173051
N-[(8-methoxyquinolin-2-yl)methyl]-3-methylpentan-3-amine
CID 106328471
N-[(8-methoxyquinolin-2-yl)methyl]-2-methylbutan-1-amine
CID 80703435
5-[(8-methoxyquinolin-2-yl)methylamino]pentan-1-ol
CID 107316801
2-[(8-methoxyquinolin-2-yl)methylamino]ethanesulfonamide
CID 80702043
N-[2-(8-methoxyquinolin-2-yl)ethyl]propan-1-amine
CID 80703316
1-(8-methoxyquinolin-2-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]methanamine
CID 80702048
N-[(8-methoxyquinolin-2-yl)methyl]-3-propan-2-yloxypropan-1-amine
CID 80701789
N-[(8-methoxyquinolin-2-yl)methyl]-2-(1,2,4-oxadiazol-5-yl)ethanamine
CID 106395260
N-[(8-methoxyquinolin-2-yl)methyl]-1H-pyrazol-4-amine
CID 80701790
3-[(8-methoxyquinolin-2-yl)methylamino]phenol
CID 80702906
(2R)-1-(8-methoxyquinolin-2-yl)-N-methylpropan-2-amine
CID 59649232

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine?
The IUPAC name of 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine (CID 104759612) is 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine.
What is the SMILES notation for 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine?
The canonical SMILES for 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine is COc1cccc2ccc(CNCC(C)(C)OC)nc12.
What is the InChIKey of 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine?
The InChIKey is GPNNYQZKBXEFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-16(2,20-4)11-17-10-13-9-8-12-6-5-7-14(19-3)15(12)18-13/h5-9,17H,10-11H2,1-4H3.
What are the key properties of 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine?
2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine has a molecular weight of 274.36 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(8-methoxyquinolin-2-yl)methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 104759612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).