1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine

C15H19NO3 — CID 62441796

IUPAC1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine
SMILESCCOc1cccc(OCc2occc2CNC)c1
InChIInChI=1S/C15H19NO3/c1-3-17-13-5-4-6-14(9-13)19-11-15-12(10-16-2)7-8-18-15/h4-9,16H,3,10-11H2,1-2H3
InChIKeyFLHWNSZVLQVPQH-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.98
Rot. Bonds7

About 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine

1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine (PubChem CID 62441796) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine
PubChem CID62441796
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine
SMILESCCOc1cccc(OCc2occc2CNC)c1
InChIInChI=1S/C15H19NO3/c1-3-17-13-5-4-6-14(9-13)19-11-15-12(10-16-2)7-8-18-15/h4-9,16H,3,10-11H2,1-2H3
InChIKeyFLHWNSZVLQVPQH-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

1-[2-[(3,4-dimethylphenoxy)methyl]furan-3-yl]-N-methylmethanamine
CID 62452690
1-[2-[(3,5-dimethylphenoxy)methyl]furan-3-yl]-N-methylmethanamine
CID 62452698
N-methyl-1-[2-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62451011
N-[[2-[(3-methylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62452706
N-methyl-1-[2-[(4-propylphenoxy)methyl]furan-3-yl]methanamine
CID 62548754
1-[5-[(3-ethoxyphenoxy)methyl]-2-methylfuran-3-yl]-N-methylmethanamine
CID 62442170
N-[[2-[(3-fluorophenoxy)methyl]furan-3-yl]methyl]propan-1-amine
CID 62460294
N-[[2-[(3-methylphenoxy)methyl]furan-3-yl]methyl]propan-2-amine
CID 62452883
N-[[2-[(3-methylsulfonylphenoxy)methyl]furan-3-yl]methyl]ethanamine
CID 62484329
N-[[2-[(3-fluorophenoxy)methyl]furan-3-yl]methyl]-2-methylpropan-1-amine
CID 62460473
[2-[(3-chlorophenoxy)methyl]furan-3-yl]methanamine
CID 62459366
N-[(3-bromofuran-2-yl)methyl]-3-ethoxyaniline
CID 103817901

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine (CID 62441796) is 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine is CCOc1cccc(OCc2occc2CNC)c1.
What is the InChIKey of 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine?
The InChIKey is FLHWNSZVLQVPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-3-17-13-5-4-6-14(9-13)19-11-15-12(10-16-2)7-8-18-15/h4-9,16H,3,10-11H2,1-2H3.
What are the key properties of 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine?
1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine 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 1-[2-[(3-ethoxyphenoxy)methyl]furan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 62441796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).