2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine

C16H16N2O — CID 105177547

IUPAC2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine
SMILESCNC(Cc1ccoc1)c1cccc2cccnc12
InChIInChI=1S/C16H16N2O/c1-17-15(10-12-7-9-19-11-12)14-6-2-4-13-5-3-8-18-16(13)14/h2-9,11,15,17H,10H2,1H3
InChIKeyVHONUEWSGNQIFR-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.33
Rot. Bonds4

About 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine

2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine (PubChem CID 105177547) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine
PubChem CID105177547
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine
SMILESCNC(Cc1ccoc1)c1cccc2cccnc12
InChIInChI=1S/C16H16N2O/c1-17-15(10-12-7-9-19-11-12)14-6-2-4-13-5-3-8-18-16(13)14/h2-9,11,15,17H,10H2,1H3
InChIKeyVHONUEWSGNQIFR-UHFFFAOYSA-N
XLogP3.33
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine?
The IUPAC name of 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine (CID 105177547) is 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine.
What is the SMILES notation for 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine?
The canonical SMILES for 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine is CNC(Cc1ccoc1)c1cccc2cccnc12.
What is the InChIKey of 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine?
The InChIKey is VHONUEWSGNQIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-17-15(10-12-7-9-19-11-12)14-6-2-4-13-5-3-8-18-16(13)14/h2-9,11,15,17H,10H2,1H3.
What are the key properties of 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine?
2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine has a molecular weight of 252.32 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine is sourced from PubChem (CID 105177547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).