1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine

C15H19NO2 — CID 114249002

IUPAC1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)c(C)o1)c1ccccc1OC
InChIInChI=1S/C15H19NO2/c1-10-9-14(18-11(10)2)15(16-3)12-7-5-6-8-13(12)17-4/h5-9,15-16H,1-4H3
InChIKeyAVEIJCWBTCGBKU-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.21
Rot. Bonds4

About 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine

1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine (PubChem CID 114249002) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine
PubChem CID114249002
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cc(C)c(C)o1)c1ccccc1OC
InChIInChI=1S/C15H19NO2/c1-10-9-14(18-11(10)2)15(16-3)12-7-5-6-8-13(12)17-4/h5-9,15-16H,1-4H3
InChIKeyAVEIJCWBTCGBKU-UHFFFAOYSA-N
XLogP3.21
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 114727498
1-(2,4-dimethylphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 43482690
1-(4,5-dimethylfuran-2-yl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 114249001
1-(2-methoxy-4-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 106792109
1-(1-benzofuran-2-yl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 63089905
1-(4,5-dimethoxy-2-methylphenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 43626718
1-(2-fluoro-5-methylphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 62790144
1-(2-methoxyphenyl)-N-methyl-1-pyridin-4-ylmethanamine
CID 60819715
1-(2-fluoro-3-methoxyphenyl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 82808523
1-(2-chlorofuran-3-yl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 106691466
1-(4-bromo-5-methylthiophen-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine
CID 102827334
1-(2-methoxyphenyl)-N,N'-dimethylmethanediamine
CID 116954416

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine (CID 114249002) is 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine is CNC(c1cc(C)c(C)o1)c1ccccc1OC.
What is the InChIKey of 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine?
The InChIKey is AVEIJCWBTCGBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-10-9-14(18-11(10)2)15(16-3)12-7-5-6-8-13(12)17-4/h5-9,15-16H,1-4H3.
What are the key properties of 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine?
1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine has a molecular weight of 245.32 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethylfuran-2-yl)-1-(2-methoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 114249002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).