N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine

C15H20N2O2 — CID 81231933

IUPACN-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
SMILESCCNC(c1cccc2ncccc12)C(OC)OC
InChIInChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-5-9-13-11(12)8-6-10-17-13/h5-10,14-16H,4H2,1-3H3
InChIKeyFWEZTIUQAGAEMU-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.50
Rot. Bonds6

About N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine

N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine (PubChem CID 81231933) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
PubChem CID81231933
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
SMILESCCNC(c1cccc2ncccc12)C(OC)OC
InChIInChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-5-9-13-11(12)8-6-10-17-13/h5-10,14-16H,4H2,1-3H3
InChIKeyFWEZTIUQAGAEMU-UHFFFAOYSA-N
XLogP2.50
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine
CID 116723731
N-ethyl-1-quinolin-5-ylpentan-1-amine
CID 81231643
N-ethyl-1-quinolin-5-ylhexan-1-amine
CID 105020078
N-[pyridin-2-yl(quinolin-5-yl)methyl]ethanamine
CID 81220016
N-ethyl-1-quinolin-5-ylprop-2-yn-1-amine
CID 105158296
N,3-diethyl-1-quinolin-5-ylpentan-1-amine
CID 105176769
N-[furan-3-yl(quinolin-5-yl)methyl]ethanamine
CID 81232108
N-[(5-methylpyrazin-2-yl)-quinolin-5-ylmethyl]ethanamine
CID 105172000
N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
CID 81232075
N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine
CID 81232158
N-[(2-bromofuran-3-yl)-quinolin-5-ylmethyl]ethanamine
CID 106858308
N-[pyrimidin-4-yl(quinolin-5-yl)methyl]ethanamine
CID 81231393

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine?
The IUPAC name of N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine (CID 81231933) is N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine.
What is the SMILES notation for N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine?
The canonical SMILES for N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine is CCNC(c1cccc2ncccc12)C(OC)OC.
What is the InChIKey of N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine?
The InChIKey is FWEZTIUQAGAEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-16-14(15(18-2)19-3)12-7-5-9-13-11(12)8-6-10-17-13/h5-10,14-16H,4H2,1-3H3.
What are the key properties of N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine?
N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine has a molecular weight of 260.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine is sourced from PubChem (CID 81231933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).