3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine

C15H20N2O — CID 113391406

IUPAC3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine
SMILESCNC(CC(C)OC)c1ccc2cccnc2c1
InChIInChI=1S/C15H20N2O/c1-11(18-3)9-14(16-2)13-7-6-12-5-4-8-17-15(12)10-13/h4-8,10-11,14,16H,9H2,1-3H3
InChIKeyHLOBPDDIHAPFFO-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.92
Rot. Bonds5

About 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine

3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine (PubChem CID 113391406) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine
PubChem CID113391406
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine
SMILESCNC(CC(C)OC)c1ccc2cccnc2c1
InChIInChI=1S/C15H20N2O/c1-11(18-3)9-14(16-2)13-7-6-12-5-4-8-17-15(12)10-13/h4-8,10-11,14,16H,9H2,1-3H3
InChIKeyHLOBPDDIHAPFFO-UHFFFAOYSA-N
XLogP2.92
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-Methylquinoline
CID 11927
Diethyl[4-(4-quinolylamino)pentyl]amine
CID 474865
US9682968, Example-4b (+)
CID 90468037
N-(quinolin-6-yl)acetamide
CID 31176
Diethyl(4-{[7-(trifluoromethyl)(4-quinolyl)]amino}pentyl)amine
CID 224869
4,7-Dimethylquinoline
CID 123499
N',N'-diethyl-N-(7-methylquinolin-4-yl)ethane-1,2-diamine
CID 44344810
N'-(7-methylquinolin-4-yl)ethane-1,2-diamine
CID 71713001
2-(Quinolin-4-yl)ethan-1-amine
CID 20192901
1-N,1-N-diethyl-2-N-[7-(trifluoromethyl)quinolin-4-yl]propane-1,2-diamine
CID 10520098
N',N'-diethyl-N-[7-(trifluoromethyl)quinolin-4-yl]propane-1,3-diamine
CID 10687513
4-[5-(Diethylamino)pentan-2-ylamino]quinoline-7-carbonitrile
CID 44532012

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine?
The IUPAC name of 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine (CID 113391406) is 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine.
What is the SMILES notation for 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine?
The canonical SMILES for 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine is CNC(CC(C)OC)c1ccc2cccnc2c1.
What is the InChIKey of 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine?
The InChIKey is HLOBPDDIHAPFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(18-3)9-14(16-2)13-7-6-12-5-4-8-17-15(12)10-13/h4-8,10-11,14,16H,9H2,1-3H3.
What are the key properties of 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine?
3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-methyl-1-quinolin-7-ylbutan-1-amine is sourced from PubChem (CID 113391406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).