N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine

C17H18N2O2 — CID 107387788

IUPACN-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1COc1cnc2ccccc2c1
InChIInChI=1S/C17H18N2O2/c1-2-18-10-14-7-8-20-17(14)12-21-15-9-13-5-3-4-6-16(13)19-11-15/h3-9,11,18H,2,10,12H2,1H3
InChIKeyGJORNVYPYNNJDN-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.52
Rot. Bonds6

About N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine

N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine (PubChem CID 107387788) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine
PubChem CID107387788
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1ccoc1COc1cnc2ccccc2c1
InChIInChI=1S/C17H18N2O2/c1-2-18-10-14-7-8-20-17(14)12-21-15-9-13-5-3-4-6-16(13)19-11-15/h3-9,11,18H,2,10,12H2,1H3
InChIKeyGJORNVYPYNNJDN-UHFFFAOYSA-N
XLogP3.52
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-[(3-methylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62452706
N-[[2-[(2-prop-1-enylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 76943591
N-[[2-[(2-tert-butylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62452007
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553
5-ethyl-3-(quinolin-3-yloxymethyl)-1,2,4-oxadiazole
CID 102847040
N-[[2-[(2,4-difluorophenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62449654
N-[[2-[(2,5-difluorophenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 63273237
N-[[2-[(2-bromophenyl)methoxymethyl]furan-3-yl]methyl]ethanamine
CID 82825719
N-methyl-1-[2-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62451011
1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine
CID 62441796
2-quinolin-3-yloxyethanol
CID 102847036
3-(bromomethoxy)quinoline
CID 54277099

Frequently Asked Questions

What is the IUPAC name of N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine (CID 107387788) is N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine is CCNCc1ccoc1COc1cnc2ccccc2c1.
What is the InChIKey of N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine?
The InChIKey is GJORNVYPYNNJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-2-18-10-14-7-8-20-17(14)12-21-15-9-13-5-3-4-6-16(13)19-11-15/h3-9,11,18H,2,10,12H2,1H3.
What are the key properties of N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine?
N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine has a molecular weight of 282.34 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(quinolin-3-yloxymethyl)furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 107387788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).