1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine

C15H19NO3 — CID 63986399

IUPAC1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
SMILESCNCc1ccc(COc2cccc(COC)c2)o1
InChIInChI=1S/C15H19NO3/c1-16-9-14-6-7-15(19-14)11-18-13-5-3-4-12(8-13)10-17-2/h3-8,16H,9-11H2,1-2H3
InChIKeyUDLKZYHUXDJGML-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.72
Rot. Bonds7

About 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine

1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine (PubChem CID 63986399) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
PubChem CID63986399
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine
SMILESCNCc1ccc(COc2cccc(COC)c2)o1
InChIInChI=1S/C15H19NO3/c1-16-9-14-6-7-15(19-14)11-18-13-5-3-4-12(8-13)10-17-2/h3-8,16H,9-11H2,1-2H3
InChIKeyUDLKZYHUXDJGML-UHFFFAOYSA-N
XLogP2.72
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 ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-[(3-ethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62452138
1-[5-[(3-bromophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62459188
N-methyl-1-[3-[(5-methylfuran-2-yl)methoxy]phenyl]methanamine
CID 106486033
N-methyl-1-[5-[(3-methylsulfonylphenoxy)methyl]furan-2-yl]methanamine
CID 62484331
1-[3-[(5-bromofuran-2-yl)methoxy]phenyl]-N-methylmethanamine
CID 106485972
N-methyl-1-[5-(naphthalen-2-yloxymethyl)furan-2-yl]methanamine
CID 62460500
1-[3-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]phenyl]-N-methylmethanamine
CID 66157214
1-[5-[(3,5-dimethylphenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62453412
1-(methoxymethyl)-3-phenylmethoxybenzene
CID 59224255
N-[[5-[[3-(methoxymethyl)phenoxy]methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 63985026
1-[5-[(3,5-difluorophenoxy)methyl]furan-2-yl]-N-methylmethanamine
CID 62783791
5-[[3-(methoxymethyl)phenoxy]methyl]-3-methylfuran-2-carbohydrazide
CID 63985457

Frequently Asked Questions

What is the IUPAC name of 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine (CID 63986399) is 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine is CNCc1ccc(COc2cccc(COC)c2)o1.
What is the InChIKey of 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine?
The InChIKey is UDLKZYHUXDJGML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-16-9-14-6-7-15(19-14)11-18-13-5-3-4-12(8-13)10-17-2/h3-8,16H,9-11H2,1-2H3.
What are the key properties of 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine?
1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine has a molecular weight of 261.32 g/mol, XLogP of 2.72, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[[3-(methoxymethyl)phenoxy]methyl]furan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 63986399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).