N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine

C15H19NO3 — CID 62454887

IUPACN-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(COc2cccc(OC)c2)o1
InChIInChI=1S/C15H19NO3/c1-3-16-10-14-7-8-15(19-14)11-18-13-6-4-5-12(9-13)17-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyZZPOCZYNQZEKIM-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.98
Rot. Bonds7

About N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine

N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine (PubChem CID 62454887) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine
PubChem CID62454887
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC NameN-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine
SMILESCCNCc1ccc(COc2cccc(OC)c2)o1
InChIInChI=1S/C15H19NO3/c1-3-16-10-14-7-8-15(19-14)11-18-13-6-4-5-12(9-13)17-2/h4-9,16H,3,10-11H2,1-2H3
InChIKeyZZPOCZYNQZEKIM-UHFFFAOYSA-N
XLogP2.98
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(3-methoxyphenyl)furan-2-yl]methyl]ethanamine
CID 106886886
N-[[3-[(3-methoxyphenoxy)methyl]phenyl]methyl]ethanamine
CID 62453859
5-[(3-methoxyphenoxy)methyl]furan-2-carbaldehyde
CID 97035067
N-[[5-[(4-chlorophenoxy)methyl]furan-2-yl]methyl]ethanamine
CID 62453744
N-[[5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-yl]methyl]ethanamine
CID 62484481
N-[[5-[(3-iodophenoxy)methyl]furan-2-yl]methyl]propan-1-amine
CID 55077107
N,N-dimethyl-3-[[5-(propylaminomethyl)furan-2-yl]methoxy]aniline
CID 62484354
N-[[5-[(2,5-dimethylphenoxy)methyl]furan-2-yl]methyl]ethanamine
CID 62453396
1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62452138
N-[[5-[(3-ethoxyphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62443165
1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
CID 63986399
N-[[3-bromo-4-[(3-methoxyphenoxy)methyl]phenyl]methyl]ethanamine
CID 102772906

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine (CID 62454887) is N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine is CCNCc1ccc(COc2cccc(OC)c2)o1.
What is the InChIKey of N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine?
The InChIKey is ZZPOCZYNQZEKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-3-16-10-14-7-8-15(19-14)11-18-13-6-4-5-12(9-13)17-2/h4-9,16H,3,10-11H2,1-2H3.
What are the key properties of N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine?
N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine has a molecular weight of 261.32 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(3-methoxyphenoxy)methyl]furan-2-yl]methyl]ethanamine is sourced from PubChem (CID 62454887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).