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

C17H22N2O — CID 103169273

IUPAC2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine
SMILESCCOC1CC(CC(N)c2ccc3ncccc3c2)C1
InChIInChI=1S/C17H22N2O/c1-2-20-15-8-12(9-15)10-16(18)13-5-6-17-14(11-13)4-3-7-19-17/h3-7,11-12,15-16H,2,8-10,18H2,1H3
InChIKeyGMQHUXREWXMVEC-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.44
Rot. Bonds5

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

2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine (PubChem CID 103169273) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine
PubChem CID103169273
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine
SMILESCCOC1CC(CC(N)c2ccc3ncccc3c2)C1
InChIInChI=1S/C17H22N2O/c1-2-20-15-8-12(9-15)10-16(18)13-5-6-17-14(11-13)4-3-7-19-17/h3-7,11-12,15-16H,2,8-10,18H2,1H3
InChIKeyGMQHUXREWXMVEC-UHFFFAOYSA-N
XLogP3.44
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
CID 103169272
2-(oxolan-3-yl)-1-quinolin-6-ylethanamine
CID 103986818
1-quinolin-6-ylbutan-1-amine
CID 63095616
1-quinolin-6-yldecan-1-amine
CID 63418413
2-(1,1-dioxothiolan-3-yl)-1-quinolin-6-ylethanamine
CID 105172342
N-(3-ethoxycyclobutyl)quinolin-6-amine
CID 112573906
5-methyl-1-quinolin-6-ylhexan-1-amine
CID 83161358
2-(3-ethoxycyclobutyl)-1-(3-propan-2-yloxyphenyl)ethanamine
CID 103169245
ethyl (2R)-2-quinolin-6-ylpropanoate
CID 86328869
4-methoxy-1-quinolin-6-ylbutan-1-amine
CID 78924718
N',N'-diethyl-1-quinolin-6-ylpropane-1,3-diamine
CID 81231421
2-propylsulfanyl-1-quinolin-6-ylethanamine
CID 81231903

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine?
The IUPAC name of 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine (CID 103169273) is 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine is CCOC1CC(CC(N)c2ccc3ncccc3c2)C1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine?
The InChIKey is GMQHUXREWXMVEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-2-20-15-8-12(9-15)10-16(18)13-5-6-17-14(11-13)4-3-7-19-17/h3-7,11-12,15-16H,2,8-10,18H2,1H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine?
2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine has a molecular weight of 270.38 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-1-quinolin-6-ylethanamine is sourced from PubChem (CID 103169273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).