1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine

C17H17ClN2O — CID 106688064

IUPAC1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine
SMILESCCNC(Cc1ccc2ccccc2n1)c1ccoc1Cl
InChIInChI=1S/C17H17ClN2O/c1-2-19-16(14-9-10-21-17(14)18)11-13-8-7-12-5-3-4-6-15(12)20-13/h3-10,16,19H,2,11H2,1H3
InChIKeyXROZHEFKRVGIIN-UHFFFAOYSA-N
MW300.79 g/mol
LogP4.37
Rot. Bonds5

About 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine

1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine (PubChem CID 106688064) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine.

Molecular Properties

Compound Name1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine
PubChem CID106688064
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC Name1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine
SMILESCCNC(Cc1ccc2ccccc2n1)c1ccoc1Cl
InChIInChI=1S/C17H17ClN2O/c1-2-19-16(14-9-10-21-17(14)18)11-13-8-7-12-5-3-4-6-15(12)20-13/h3-10,16,19H,2,11H2,1H3
InChIKeyXROZHEFKRVGIIN-UHFFFAOYSA-N
XLogP4.37
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorofuran-3-yl)-N-ethyl-2-pyridin-4-ylethanamine
CID 106688072
1-(2-chlorofuran-3-yl)-N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 106692760
2-N-ethyl-1-N,1-N-dimethyl-3-quinolin-2-ylpropane-1,2-diamine
CID 79093692
N-ethyl-1-quinolin-2-ylpent-4-en-2-amine
CID 116660895
N-[(2-chlorofuran-3-yl)-quinolin-7-ylmethyl]ethanamine
CID 106692808
1-(2-chlorofuran-3-yl)-2-(2,5-dimethylpyrazol-3-yl)-N-ethylethanamine
CID 106692336
N-ethyl-3-(oxolan-2-yl)-1-quinolin-2-ylpropan-1-amine
CID 65164311
N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine
CID 63950003
N-[1-(2-chlorofuran-3-yl)-2-(5-ethyl-2-pyridinyl)ethyl]propan-1-amine
CID 106692662
1-(2,2-dimethylcyclopropyl)-N-ethyl-2-quinolin-2-ylethanamine
CID 107001995
N-ethyl-3-methoxy-3-methyl-1-quinolin-2-ylpentan-2-amine
CID 116758103
N-[1-(2-chlorofuran-3-yl)-2-(2,6-dichlorophenyl)ethyl]propan-1-amine
CID 106691671

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine?
The IUPAC name of 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine (CID 106688064) is 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine.
What is the SMILES notation for 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine?
The canonical SMILES for 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine is CCNC(Cc1ccc2ccccc2n1)c1ccoc1Cl.
What is the InChIKey of 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine?
The InChIKey is XROZHEFKRVGIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O/c1-2-19-16(14-9-10-21-17(14)18)11-13-8-7-12-5-3-4-6-15(12)20-13/h3-10,16,19H,2,11H2,1H3.
What are the key properties of 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine?
1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine has a molecular weight of 300.79 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorofuran-3-yl)-N-ethyl-2-quinolin-2-ylethanamine is sourced from PubChem (CID 106688064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).