2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine

C14H17NO3 — CID 16784253

IUPAC2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine
SMILESCOc1cccc(OCC(N)c2ccc(C)o2)c1
InChIInChI=1S/C14H17NO3/c1-10-6-7-14(18-10)13(15)9-17-12-5-3-4-11(8-12)16-2/h3-8,13H,9,15H2,1-2H3
InChIKeyLHJQQFDFPFAKHI-UHFFFAOYSA-N
MW247.29 g/mol
LogP2.68
Rot. Bonds5

About 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine

2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine (PubChem CID 16784253) has the molecular formula C14H17NO3 and a molecular weight of 247.29 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine
PubChem CID16784253
Molecular FormulaC14H17NO3
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine
SMILESCOc1cccc(OCC(N)c2ccc(C)o2)c1
InChIInChI=1S/C14H17NO3/c1-10-6-7-14(18-10)13(15)9-17-12-5-3-4-11(8-12)16-2/h3-8,13H,9,15H2,1-2H3
InChIKeyLHJQQFDFPFAKHI-UHFFFAOYSA-N
XLogP2.68
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine
CID 16795378
2-(3-methoxyphenoxy)-1-(2,4,6-trimethylphenyl)ethanamine
CID 43105318
2-(3-ethoxyphenoxy)-1-(3-methoxyphenyl)ethanamine
CID 62336890
2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine
CID 117241389
(4-methoxy-2-methylphenyl)-(5-methylfuran-2-yl)methanamine
CID 43464444
2-(4-ethoxyphenoxy)-1-(3-methoxyphenyl)ethanamine
CID 16791340
2-(5-chlorofuran-2-yl)-3-(3-methoxyphenoxy)propan-1-amine
CID 117240604
N-(3-methoxyphenyl)-1-(5-methylfuran-2-yl)ethane-1,2-diamine
CID 65379203
1-(5-bromofuran-2-yl)-2-(3-chlorophenoxy)ethanamine
CID 117240114
2-[3-(methoxymethyl)phenoxy]-1-(4-methoxyphenyl)ethanamine
CID 63986560
2-(5-methylfuran-2-yl)-3-[3-(trifluoromethyl)phenoxy]propan-1-amine
CID 117240547
4-methoxy-1-(5-methylfuran-2-yl)butan-1-amine
CID 105054856

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine (CID 16784253) is 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine is COc1cccc(OCC(N)c2ccc(C)o2)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine?
The InChIKey is LHJQQFDFPFAKHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO3/c1-10-6-7-14(18-10)13(15)9-17-12-5-3-4-11(8-12)16-2/h3-8,13H,9,15H2,1-2H3.
What are the key properties of 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine?
2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine has a molecular weight of 247.29 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-1-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 16784253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).