1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine

C16H21NO2 — CID 79095977

IUPAC1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccc(OC)c(C)c2)o1
InChIInChI=1S/C16H21NO2/c1-5-13-7-9-15(19-13)16(17-3)12-6-8-14(18-4)11(2)10-12/h6-10,16-17H,5H2,1-4H3
InChIKeyIUGWFLNBPILHOH-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.47
Rot. Bonds5

About 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine

1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine (PubChem CID 79095977) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
PubChem CID79095977
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)c2ccc(OC)c(C)c2)o1
InChIInChI=1S/C16H21NO2/c1-5-13-7-9-15(19-13)16(17-3)12-6-8-14(18-4)11(2)10-12/h6-10,16-17H,5H2,1-4H3
InChIKeyIUGWFLNBPILHOH-UHFFFAOYSA-N
XLogP3.47
TPSA34.40 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 ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dimethylphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346046
1-(5-chloro-2-methoxyphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346399
1-(2,3-dihydro-1H-inden-5-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 62346567
1-(4-bromo-2,5-dimethoxyphenyl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 105056762
5-[(5-ethylfuran-2-yl)-(methylamino)methyl]-1,3-dihydrobenzimidazol-2-one
CID 79096507
1-(2-fluoro-3-methoxyphenyl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
CID 82792923
N-[(5-chlorofuran-2-yl)-(4-methoxy-3-methylphenyl)methyl]propan-1-amine
CID 106684318
1-(5-ethylfuran-2-yl)-N-methyl-1-thiophen-3-ylmethanamine
CID 62345338
1-(5-bromothiophen-3-yl)-1-(5-ethylfuran-2-yl)-N-methylmethanamine
CID 107960959
1-(3-fluoro-4-methoxyphenyl)-N-methyl-1-(5-methylfuran-2-yl)methanamine
CID 43487598
N-[(5-ethylfuran-2-yl)-(4-fluoro-3-methylphenyl)methyl]propan-1-amine
CID 63210049
1-(5-ethylfuran-2-yl)-1-(5-fluoro-2-methylphenyl)-N-methylmethanamine
CID 63048430

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine (CID 79095977) is 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine is CCc1ccc(C(NC)c2ccc(OC)c(C)c2)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
The InChIKey is IUGWFLNBPILHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-5-13-7-9-15(19-13)16(17-3)12-6-8-14(18-4)11(2)10-12/h6-10,16-17H,5H2,1-4H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine?
1-(5-ethylfuran-2-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine has a molecular weight of 259.35 g/mol, XLogP of 3.47, 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)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 79095977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).