2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine

C15H20N2O — CID 116719597

IUPAC2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine
SMILESCOC(C(C)C)C(N)c1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-10(2)15(18-3)14(16)12-8-11-6-4-5-7-13(11)17-9-12/h4-10,14-15H,16H2,1-3H3
InChIKeyQBNOFPMGVRBXDI-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.91
Rot. Bonds4

About 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine

2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine (PubChem CID 116719597) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine.

Molecular Properties

Compound Name2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine
PubChem CID116719597
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine
SMILESCOC(C(C)C)C(N)c1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-10(2)15(18-3)14(16)12-8-11-6-4-5-7-13(11)17-9-12/h4-10,14-15H,16H2,1-3H3
InChIKeyQBNOFPMGVRBXDI-UHFFFAOYSA-N
XLogP2.91
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-1-quinolin-3-ylpropan-1-amine
CID 64542181
2-methoxy-3-methyl-N-propyl-1-quinolin-3-ylbutan-1-amine
CID 116720466
2-ethoxy-1-quinolin-3-ylbutan-1-amine
CID 116716202
2-phenyl-1-quinolin-3-ylbutan-1-amine
CID 115798275
2-ethoxy-N,3-dimethyl-1-quinolin-3-ylbutan-1-amine
CID 116721032
2-(4-methoxyphenyl)-1-quinolin-3-ylethanamine
CID 61373627
fluoro(quinolin-3-yl)methanol
CID 163892772
2,2-dimethyl-1-quinolin-3-ylpropan-1-ol
CID 60924299
(4-methoxythiophen-2-yl)-quinolin-3-ylmethanamine
CID 115798693
ethyl (3S)-3-amino-3-quinolin-3-ylpropanoate
CID 34177500
2-methoxy-N,3-dimethyl-1-quinolin-6-ylbutan-1-amine
CID 116720092
1-(4-quinolin-3-ylphenyl)ethanamine
CID 61025772

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine?
The IUPAC name of 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine (CID 116719597) is 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine.
What is the SMILES notation for 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine?
The canonical SMILES for 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine is COC(C(C)C)C(N)c1cnc2ccccc2c1.
What is the InChIKey of 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine?
The InChIKey is QBNOFPMGVRBXDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10(2)15(18-3)14(16)12-8-11-6-4-5-7-13(11)17-9-12/h4-10,14-15H,16H2,1-3H3.
What are the key properties of 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine?
2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine is sourced from PubChem (CID 116719597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).