N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine

C16H16N2O2 — CID 103045894

IUPACN-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine
SMILESc1coc(CNCCOc2cccc3ncccc23)c1
InChIInChI=1S/C16H16N2O2/c1-6-15-14(5-2-8-18-15)16(7-1)20-11-9-17-12-13-4-3-10-19-13/h1-8,10,17H,9,11-12H2
InChIKeyBBNKMDZQVYKDDC-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.00
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine

N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine (PubChem CID 103045894) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine
PubChem CID103045894
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine
SMILESc1coc(CNCCOc2cccc3ncccc23)c1
InChIInChI=1S/C16H16N2O2/c1-6-15-14(5-2-8-18-15)16(7-1)20-11-9-17-12-13-4-3-10-19-13/h1-8,10,17H,9,11-12H2
InChIKeyBBNKMDZQVYKDDC-UHFFFAOYSA-N
XLogP3.00
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-N-(2-quinolin-5-yloxyethyl)butan-1-amine
CID 103045848
N-(2-quinolin-5-yloxyethyl)pentan-3-amine
CID 103045833
2-(2,4-difluorophenoxy)-N-(furan-2-ylmethyl)ethanamine
CID 62573014
4-bromo-N-(2-quinolin-5-yloxyethyl)aniline
CID 103045838
N-(furan-2-ylmethyl)-2-(2,4,6-trichlorophenoxy)ethanamine
CID 62572364
2-methoxy-N-(quinolin-5-ylmethyl)ethanamine
CID 62543986
N-(furan-2-ylmethyl)-2-(4-methoxyphenoxy)ethanamine
CID 2299658
N-[4-(2-quinolin-5-yloxyethylamino)butyl]benzamide
CID 15840789
4-(4-chloronaphthalen-1-yl)oxy-N-(furan-2-ylmethyl)butan-1-amine
CID 56689586
5-(9-bromononoxy)quinoline
CID 103044601
5-(3,3-dimethylbutoxy)quinoline
CID 59667943
6-quinolin-5-yloxyhexane-1-thiol
CID 103046109

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine?
The IUPAC name of N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine (CID 103045894) is N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine is c1coc(CNCCOc2cccc3ncccc23)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine?
The InChIKey is BBNKMDZQVYKDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-6-15-14(5-2-8-18-15)16(7-1)20-11-9-17-12-13-4-3-10-19-13/h1-8,10,17H,9,11-12H2.
What are the key properties of N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine?
N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine has a molecular weight of 268.32 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-quinolin-5-yloxyethanamine is sourced from PubChem (CID 103045894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).