1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine

C16H21NO2 — CID 115826366

IUPAC1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
SMILESCCc1ccc(C(N)Cc2cc(C)ccc2OC)o1
InChIInChI=1S/C16H21NO2/c1-4-13-6-8-16(19-13)14(17)10-12-9-11(2)5-7-15(12)18-3/h5-9,14H,4,10,17H2,1-3H3
InChIKeyICVCPPSJIVKXBL-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.40
Rot. Bonds5

About 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine

1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine (PubChem CID 115826366) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
PubChem CID115826366
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
SMILESCCc1ccc(C(N)Cc2cc(C)ccc2OC)o1
InChIInChI=1S/C16H21NO2/c1-4-13-6-8-16(19-13)14(17)10-12-9-11(2)5-7-15(12)18-3/h5-9,14H,4,10,17H2,1-3H3
InChIKeyICVCPPSJIVKXBL-UHFFFAOYSA-N
XLogP3.40
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-5-methylphenyl)butan-2-amine;hydrochloride
CID 170889680
1,1-diethoxy-3-(2-methoxy-5-methylphenyl)propan-2-amine
CID 79495090
1-(2-methoxy-5-methylphenyl)undecan-2-amine
CID 115826519
1-(2,6-dimethyl-4-pyridinyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 107503260
1-butan-2-ylsulfanyl-3-(2-methoxy-5-methylphenyl)propan-2-amine
CID 65136479
1-(2-methoxy-5-methylphenyl)-5-methylhexan-2-amine
CID 55041467
1-(5-bromo-2-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826789
butane;1-methoxy-4-methyl-2-(2-methylbutyl)benzene
CID 144898289
4,4,4-trifluoro-1-(2-methoxy-5-methylphenyl)-3-(trifluoromethyl)butan-2-amine
CID 103311787
2-(2-methoxy-5-methylphenyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 115826565
1-(4,5-dimethylthiophen-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826649
1-(2-fluoro-3-methylphenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
CID 115826307

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine (CID 115826366) is 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine is CCc1ccc(C(N)Cc2cc(C)ccc2OC)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The InChIKey is ICVCPPSJIVKXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-4-13-6-8-16(19-13)14(17)10-12-9-11(2)5-7-15(12)18-3/h5-9,14H,4,10,17H2,1-3H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine?
1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine has a molecular weight of 259.35 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylfuran-2-yl)-2-(2-methoxy-5-methylphenyl)ethanamine is sourced from PubChem (CID 115826366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).