8-[[methoxy(methyl)amino]methyl]quinolin-5-amine

C12H15N3O — CID 43627608

IUPAC8-[[methoxy(methyl)amino]methyl]quinolin-5-amine
SMILESCON(C)Cc1ccc(N)c2cccnc12
InChIInChI=1S/C12H15N3O/c1-15(16-2)8-9-5-6-11(13)10-4-3-7-14-12(9)10/h3-7H,8,13H2,1-2H3
InChIKeyFZQDIFYMSBEXMM-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.81
Rot. Bonds3

About 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine

8-[[methoxy(methyl)amino]methyl]quinolin-5-amine (PubChem CID 43627608) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine.

Molecular Properties

Compound Name8-[[methoxy(methyl)amino]methyl]quinolin-5-amine
PubChem CID43627608
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name8-[[methoxy(methyl)amino]methyl]quinolin-5-amine
SMILESCON(C)Cc1ccc(N)c2cccnc12
InChIInChI=1S/C12H15N3O/c1-15(16-2)8-9-5-6-11(13)10-4-3-7-14-12(9)10/h3-7H,8,13H2,1-2H3
InChIKeyFZQDIFYMSBEXMM-UHFFFAOYSA-N
XLogP1.81
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

8-[[1-methoxypropan-2-yl(methyl)amino]methyl]quinolin-5-amine
CID 61450348
8-[[benzyl(methyl)amino]methyl]quinolin-5-amine
CID 43375712
1-[(5-aminoquinolin-8-yl)methyl-methylamino]propan-2-ol
CID 62334736
4-[(5-aminoquinolin-8-yl)methyl-methylamino]phenol
CID 107733762
8-[(dibutylamino)methyl]quinolin-5-amine
CID 43375839
8-[[butan-2-yl(ethyl)amino]methyl]quinolin-5-amine
CID 43376007
8-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]quinolin-5-amine
CID 43375606
8-[[ethyl(2-methylpropyl)amino]methyl]quinolin-5-amine
CID 43375996
3-[(5-aminoquinolin-8-yl)methyl-methylamino]butanenitrile
CID 55174134
8-[[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]methyl]quinolin-5-amine
CID 43588221
8-[(2,5-dimethylphenoxy)methyl]quinolin-5-amine
CID 43376447
8-(2-methoxyethylsulfinylmethyl)quinolin-5-amine
CID 61286603

Frequently Asked Questions

What is the IUPAC name of 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine?
The IUPAC name of 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine (CID 43627608) is 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine.
What is the SMILES notation for 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine?
The canonical SMILES for 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine is CON(C)Cc1ccc(N)c2cccnc12.
What is the InChIKey of 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine?
The InChIKey is FZQDIFYMSBEXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-15(16-2)8-9-5-6-11(13)10-4-3-7-14-12(9)10/h3-7H,8,13H2,1-2H3.
What are the key properties of 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine?
8-[[methoxy(methyl)amino]methyl]quinolin-5-amine has a molecular weight of 217.27 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[[methoxy(methyl)amino]methyl]quinolin-5-amine is sourced from PubChem (CID 43627608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).