2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine

C18H24N2O — CID 116723731

IUPAC2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine
SMILESCCNC(c1cccc2ncccc12)C(OCC)C1CC1
InChIInChI=1S/C18H24N2O/c1-3-19-17(18(21-4-2)13-10-11-13)15-7-5-9-16-14(15)8-6-12-20-16/h5-9,12-13,17-19H,3-4,10-11H2,1-2H3
InChIKeySMZALKNUJGJGHI-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.70
Rot. Bonds7

About 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine

2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine (PubChem CID 116723731) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine
PubChem CID116723731
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine
SMILESCCNC(c1cccc2ncccc12)C(OCC)C1CC1
InChIInChI=1S/C18H24N2O/c1-3-19-17(18(21-4-2)13-10-11-13)15-7-5-9-16-14(15)8-6-12-20-16/h5-9,12-13,17-19H,3-4,10-11H2,1-2H3
InChIKeySMZALKNUJGJGHI-UHFFFAOYSA-N
XLogP3.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,2-dimethoxy-1-quinolin-5-ylethanamine
CID 81231933
N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine
CID 105157242
2-cyclopropyl-2-ethoxy-N-methyl-1-quinolin-8-ylethanamine
CID 116723492
1-cyclopropyl-1-ethoxy-N-methyl-3-quinolin-4-ylpropan-2-amine
CID 116723331
2-cyclopropyl-2-ethoxy-N-ethyl-1-(6-methyl-3-pyridinyl)ethanamine
CID 116723795
N-ethyl-1-quinolin-5-ylpentan-1-amine
CID 81231643
N-[(1-methylcyclopropyl)-quinolin-5-ylmethyl]ethanamine
CID 81232158
N-ethyl-1-quinolin-5-ylhexan-1-amine
CID 105020078
N-ethyl-1-quinolin-5-ylprop-2-yn-1-amine
CID 105158296
N-[pyridin-2-yl(quinolin-5-yl)methyl]ethanamine
CID 81220016
2-cyclopropyl-2-ethoxy-N-ethyl-1-(4-ethylphenyl)ethanamine
CID 116723659
N,3-diethyl-1-quinolin-5-ylpentan-1-amine
CID 105176769

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine?
The IUPAC name of 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine (CID 116723731) is 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine.
What is the SMILES notation for 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine?
The canonical SMILES for 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine is CCNC(c1cccc2ncccc12)C(OCC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine?
The InChIKey is SMZALKNUJGJGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-19-17(18(21-4-2)13-10-11-13)15-7-5-9-16-14(15)8-6-12-20-16/h5-9,12-13,17-19H,3-4,10-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine?
2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-ethoxy-N-ethyl-1-quinolin-5-ylethanamine is sourced from PubChem (CID 116723731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).