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

C16H16N2O — CID 63950003

IUPACN-[furan-2-yl(quinolin-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc2ccccc2n1)c1ccco1
InChIInChI=1S/C16H16N2O/c1-2-17-16(15-8-5-11-19-15)14-10-9-12-6-3-4-7-13(12)18-14/h3-11,16-17H,2H2,1H3
InChIKeyNPEKPKAQTQXSTR-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.53
Rot. Bonds4

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

N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine (PubChem CID 63950003) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[furan-2-yl(quinolin-2-yl)methyl]ethanamine
PubChem CID63950003
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC NameN-[furan-2-yl(quinolin-2-yl)methyl]ethanamine
SMILESCCNC(c1ccc2ccccc2n1)c1ccco1
InChIInChI=1S/C16H16N2O/c1-2-17-16(15-8-5-11-19-15)14-10-9-12-6-3-4-7-13(12)18-14/h3-11,16-17H,2H2,1H3
InChIKeyNPEKPKAQTQXSTR-UHFFFAOYSA-N
XLogP3.53
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 ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[phenyl(quinolin-2-yl)methyl]ethanamine
CID 63222857
N-[(4-chlorophenyl)-quinolin-2-ylmethyl]ethanamine
CID 63222767
N-[(4-methylphenyl)-quinolin-2-ylmethyl]ethanamine
CID 63222559
N-[(4-fluorophenyl)-quinolin-2-ylmethyl]ethanamine
CID 63222518
N-[furan-2-yl(isoquinolin-1-yl)methyl]ethanamine
CID 63950200
N-[cyclohexen-1-yl(quinolin-2-yl)methyl]ethanamine
CID 106652952
N-[(3-fluoro-4-pyridinyl)-quinolin-2-ylmethyl]ethanamine
CID 104738216
N-[(2,6-dimethyl-4-pyridinyl)-(furan-2-yl)methyl]ethanamine
CID 107503948
N-ethyl-2-quinolin-2-ylpentan-3-amine
CID 63560957
N-[furan-2-yl(pyrimidin-5-yl)methyl]ethanamine
CID 62715603
N-[furan-2-yl-(3,4,5-trifluorophenyl)methyl]ethanamine
CID 63185696
N-[furan-2-yl-(6-methoxypyrimidin-4-yl)methyl]ethanamine
CID 102951879

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine?
The IUPAC name of N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine (CID 63950003) is N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine?
The canonical SMILES for N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine is CCNC(c1ccc2ccccc2n1)c1ccco1.
What is the InChIKey of N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine?
The InChIKey is NPEKPKAQTQXSTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-2-17-16(15-8-5-11-19-15)14-10-9-12-6-3-4-7-13(12)18-14/h3-11,16-17H,2H2,1H3.
What are the key properties of N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine?
N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine has a molecular weight of 252.32 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(quinolin-2-yl)methyl]ethanamine is sourced from PubChem (CID 63950003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).