3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine

C16H22N2O — CID 105172706

IUPAC3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
SMILESCCNC(CCOCC)c1ccc2cccnc2c1
InChIInChI=1S/C16H22N2O/c1-3-17-15(9-11-19-4-2)14-8-7-13-6-5-10-18-16(13)12-14/h5-8,10,12,15,17H,3-4,9,11H2,1-2H3
InChIKeyQQDQWACDJUGWKP-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.31
Rot. Bonds7

About 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine

3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine (PubChem CID 105172706) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine.

Molecular Properties

Compound Name3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
PubChem CID105172706
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
SMILESCCNC(CCOCC)c1ccc2cccnc2c1
InChIInChI=1S/C16H22N2O/c1-3-17-15(9-11-19-4-2)14-8-7-13-6-5-10-18-16(13)12-14/h5-8,10,12,15,17H,3-4,9,11H2,1-2H3
InChIKeyQQDQWACDJUGWKP-UHFFFAOYSA-N
XLogP3.31
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-propan-2-ylsulfanyl-1-quinolin-7-ylethanamine
CID 81231123
N-ethyl-3-(furan-2-yl)-1-quinolin-7-ylpropan-1-amine
CID 105172573
2-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 81231185
N-ethyl-1-quinolin-7-ylethanamine
CID 81221005
3-ethoxy-N-ethyl-1-quinolin-3-ylpropan-1-amine
CID 105097975
N-ethyl-3-quinolin-7-ylbutan-2-amine
CID 81224003
[1-quinolin-7-yl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151703
(2-methoxy-1-quinolin-7-ylethyl)hydrazine
CID 105207158
N-[pyrazin-2-yl(quinolin-7-yl)methyl]ethanamine
CID 81231514
N,2-diethyl-1-quinolin-7-ylhexan-1-amine
CID 105021496
N-ethyl-1-quinolin-6-ylbut-3-en-1-amine
CID 55181079
3-ethoxy-N-methyl-1-naphthalen-2-ylpropan-1-amine
CID 112688302

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine?
The IUPAC name of 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine (CID 105172706) is 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine.
What is the SMILES notation for 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine?
The canonical SMILES for 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine is CCNC(CCOCC)c1ccc2cccnc2c1.
What is the InChIKey of 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine?
The InChIKey is QQDQWACDJUGWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-3-17-15(9-11-19-4-2)14-8-7-13-6-5-10-18-16(13)12-14/h5-8,10,12,15,17H,3-4,9,11H2,1-2H3.
What are the key properties of 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine?
3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine has a molecular weight of 258.37 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine is sourced from PubChem (CID 105172706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).