1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine

C15H19NO2 — CID 115651493

IUPAC1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine
SMILESCOc1ccccc1C(C)NCc1occc1C
InChIInChI=1S/C15H19NO2/c1-11-8-9-18-15(11)10-16-12(2)13-6-4-5-7-14(13)17-3/h4-9,12,16H,10H2,1-3H3
InChIKeyCGBLDGBTGOVBTK-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.45
Rot. Bonds5

About 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine

1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine (PubChem CID 115651493) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine
PubChem CID115651493
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine
SMILESCOc1ccccc1C(C)NCc1occc1C
InChIInChI=1S/C15H19NO2/c1-11-8-9-18-15(11)10-16-12(2)13-6-4-5-7-14(13)17-3/h4-9,12,16H,10H2,1-3H3
InChIKeyCGBLDGBTGOVBTK-UHFFFAOYSA-N
XLogP3.45
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylfuran-2-yl)methyl]-1-phenylethanamine
CID 115651338
1-(2-methoxyphenyl)-N-[(5-methylthiophen-2-yl)methyl]ethanamine
CID 43180928
1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
CID 43177778
(1R)-N-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81397936
(1S)-N-[(3-methylfuran-2-yl)methyl]-1-(4-methylphenyl)ethanamine
CID 113488659
(1S)-N-[(4-fluoro-2-methylphenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81398001
(1R)-N-[(5-ethylfuran-2-yl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81397924
1-(2-methoxyphenyl)-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine
CID 60713894
(1R)-1-(4-bromophenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine
CID 114985843
(1R)-1-(2-methoxyphenyl)-N-(pyridin-4-ylmethyl)ethanamine
CID 28624444
(1S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(2-methoxyphenyl)ethanamine
CID 81388530
5-[[[(1R)-1-(2-methoxyphenyl)ethyl]amino]methyl]-3-methylfuran-2-carboxylic acid
CID 103257716

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine (CID 115651493) is 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine is COc1ccccc1C(C)NCc1occc1C.
What is the InChIKey of 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine?
The InChIKey is CGBLDGBTGOVBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-11-8-9-18-15(11)10-16-12(2)13-6-4-5-7-14(13)17-3/h4-9,12,16H,10H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine?
1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine has a molecular weight of 245.32 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-[(3-methylfuran-2-yl)methyl]ethanamine is sourced from PubChem (CID 115651493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).