2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine

C18H24N2O — CID 103169272

IUPAC2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
SMILESCCOC1CC(CC(NC)c2ccc3ncccc3c2)C1
InChIInChI=1S/C18H24N2O/c1-3-21-16-9-13(10-16)11-18(19-2)15-6-7-17-14(12-15)5-4-8-20-17/h4-8,12-13,16,18-19H,3,9-11H2,1-2H3
InChIKeyLYJYCGWHYNNSLM-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.70
Rot. Bonds6

About 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine

2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine (PubChem CID 103169272) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
PubChem CID103169272
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
SMILESCCOC1CC(CC(NC)c2ccc3ncccc3c2)C1
InChIInChI=1S/C18H24N2O/c1-3-21-16-9-13(10-16)11-18(19-2)15-6-7-17-14(12-15)5-4-8-20-17/h4-8,12-13,16,18-19H,3,9-11H2,1-2H3
InChIKeyLYJYCGWHYNNSLM-UHFFFAOYSA-N
XLogP3.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine
CID 103169273
N-methyl-1-quinolin-6-ylpropan-1-amine
CID 63095975
1-(3,4-difluorophenyl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
CID 103162822
1-(4-butan-2-ylphenyl)-2-(3-ethoxycyclobutyl)-N-methylethanamine
CID 103162804
3-cyclopentyl-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105021015
N-(3-ethoxycyclobutyl)quinolin-6-amine
CID 112573906
N-ethyl-1-quinolin-6-ylbut-3-en-1-amine
CID 55181079
1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine
CID 64729922
2-(5-ethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylethanamine
CID 63097564
2-(3-ethoxycyclobutyl)-1-(4-fluoro-3,5-dimethylphenyl)-N-methylethanamine
CID 103163180
3-(furan-2-yl)-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105172364
2-(2-methylpropylamino)-2-quinolin-6-ylethanol
CID 63968528

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine?
The IUPAC name of 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine (CID 103169272) is 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine is CCOC1CC(CC(NC)c2ccc3ncccc3c2)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine?
The InChIKey is LYJYCGWHYNNSLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-3-21-16-9-13(10-16)11-18(19-2)15-6-7-17-14(12-15)5-4-8-20-17/h4-8,12-13,16,18-19H,3,9-11H2,1-2H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine?
2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine has a molecular weight of 284.40 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine is sourced from PubChem (CID 103169272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).