2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine

C16H21NO2 — CID 83182797

IUPAC2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNCC(Cc1ccoc1)Cc1ccccc1OC
InChIInChI=1S/C16H21NO2/c1-17-11-14(9-13-7-8-19-12-13)10-15-5-3-4-6-16(15)18-2/h3-8,12,14,17H,9-11H2,1-2H3
InChIKeyRPKRINAKENVOGA-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.91
Rot. Bonds7

About 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine

2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine (PubChem CID 83182797) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine
PubChem CID83182797
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNCC(Cc1ccoc1)Cc1ccccc1OC
InChIInChI=1S/C16H21NO2/c1-17-11-14(9-13-7-8-19-12-13)10-15-5-3-4-6-16(15)18-2/h3-8,12,14,17H,9-11H2,1-2H3
InChIKeyRPKRINAKENVOGA-UHFFFAOYSA-N
XLogP2.91
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(chloromethyl)-3-(2-methoxyphenyl)propyl]furan
CID 83182238
1-(furan-3-yl)-3-(2-methoxyphenyl)propan-2-amine
CID 83174719
2-[(2-methoxyphenyl)methyl]-N-methylbutan-1-amine
CID 62530565
2-[(2-methoxyphenyl)methyl]-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 62515411
2-[(2-methoxyphenyl)methyl]-N-methyl-4-propan-2-yloxybutan-1-amine
CID 62516668
1-(2-methoxyphenyl)-3-(methylamino)propan-2-ol
CID 64983172
3-[1-bromo-2-(2-methoxyphenyl)ethyl]furan
CID 63018381
2-[(3-fluorophenyl)methyl]-3-(furan-3-yl)-N-methylpropan-1-amine
CID 83182297
2-benzyl-N-(2-methoxyethyl)-3-(2-methoxyphenyl)propan-1-amine
CID 62725841
1-(2-chloro-6-methoxyphenyl)-2-(furan-3-yl)ethanol
CID 113456462
2-[(2-methoxyphenyl)methyl]-N-propan-2-ylpentan-1-amine
CID 62528121
2-(4-bromophenyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine
CID 79441963

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine?
The IUPAC name of 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine (CID 83182797) is 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine is CNCC(Cc1ccoc1)Cc1ccccc1OC.
What is the InChIKey of 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine?
The InChIKey is RPKRINAKENVOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-17-11-14(9-13-7-8-19-12-13)10-15-5-3-4-6-16(15)18-2/h3-8,12,14,17H,9-11H2,1-2H3.
What are the key properties of 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine?
2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine has a molecular weight of 259.35 g/mol, XLogP of 2.91, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-ylmethyl)-3-(2-methoxyphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 83182797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).